Common Name
LM ID
Instrument
Adduct / Ion
Submitter
5-HPETE
Thermo Scientific Orbitrap Exploris 240
[M-H]-
Fedorova Lab (LMAI) - Gabriele Lombardi Bendoula
[{"mz":50.872703,"intensity":88.8051986694},{"mz":52.97072663,"intensity":97.9762039185},{"mz":53.32661687,"intensity":97.3871307373},{"mz":53.48006291,"intensity":82.3410873413},{"mz":53.53240043,"intensity":85.6376953125},{"mz":55.09281506,"intensity":86.2870407104},{"mz":55.8458612,"intensity":107.3416671753},{"mz":55.94983204,"intensity":92.4341049194},{"mz":56.96144386,"intensity":92.1308898926},{"mz":57.03467144,"intensity":802.8090820313},{"mz":57.35862731,"intensity":98.8316116333},{"mz":57.92605072,"intensity":83.2084121704},{"mz":58.48667089,"intensity":86.0664291382},{"mz":59.01387849,"intensity":7675.6181640625},{"mz":59.02826134,"intensity":87.4974899292},{"mz":60.54113706,"intensity":102.9436569214},{"mz":61.05597299,"intensity":91.609161377},{"mz":61.16474303,"intensity":95.5198669434},{"mz":62.48779346,"intensity":99.7955932617},{"mz":62.80088376,"intensity":84.2553787231},{"mz":63.65407293,"intensity":95.909942627},{"mz":64.25295523,"intensity":119.2543487549},{"mz":64.34638408,"intensity":95.0763015747},{"mz":65.06480198,"intensity":85.6778182983},{"mz":65.58651032,"intensity":94.9622116089},{"mz":66.00283181,"intensity":98.8003692627},{"mz":66.42480712,"intensity":101.5146942139},{"mz":68.99730849,"intensity":103.983001709},{"mz":69.03472578,"intensity":436.4107666016},{"mz":69.09944501,"intensity":88.8133163452},{"mz":70.23560254,"intensity":102.7700805664},{"mz":70.33356,"intensity":99.3236846924},{"mz":70.45510233,"intensity":96.994720459},{"mz":71.00759924,"intensity":90.7075042725},{"mz":71.01398194,"intensity":2544.4970703125},{"mz":72.22961032,"intensity":101.1388244629},{"mz":72.47128353,"intensity":88.6596908569},{"mz":72.93750688,"intensity":113.3853530884},{"mz":74.40461909,"intensity":101.6192703247},{"mz":75.13379998,"intensity":85.3140640259},{"mz":75.69754967,"intensity":92.9744110107},{"mz":75.75848007,"intensity":85.64793396},{"mz":76.60579811,"intensity":105.0266265869},{"mz":77.22952929,"intensity":91.64087677},{"mz":77.93500585,"intensity":78.489692688},{"mz":80.35190393,"intensity":87.715385437},{"mz":80.77635051,"intensity":102.6083297729},{"mz":81.85543885,"intensity":111.3606109619},{"mz":82.26560522,"intensity":90.5925598145},{"mz":82.59363912,"intensity":90.6092529297},{"mz":82.71335055,"intensity":100.6921386719},{"mz":82.92627157,"intensity":91.2388076782},{"mz":83.05049855,"intensity":574.5855102539},{"mz":83.64640576,"intensity":102.6716690063},{"mz":83.82802726,"intensity":85.4473190308},{"mz":84.17038543,"intensity":93.8725204468},{"mz":84.83206099,"intensity":90.5893554688},{"mz":85.0297408,"intensity":121.1624298096},{"mz":85.06606035,"intensity":94.4249420166},{"mz":88.15892386,"intensity":91.2485580444},{"mz":88.39605377,"intensity":89.8345794678},{"mz":88.61538582,"intensity":98.0798950195},{"mz":88.62279027,"intensity":89.6813278198},{"mz":90.01125308,"intensity":95.5598220825},{"mz":90.32982858,"intensity":83.5480804443},{"mz":90.78469737,"intensity":87.5368881226},{"mz":91.27263799,"intensity":88.4428482056},{"mz":92.81090751,"intensity":93.619392395},{"mz":93.67899396,"intensity":97.4935455322},{"mz":93.94462261,"intensity":90.1417770386},{"mz":94.24873985,"intensity":102.4866714478},{"mz":94.72107056,"intensity":86.2694473267},{"mz":94.75200207,"intensity":84.9214324951},{"mz":95.68810585,"intensity":107.3982467651},{"mz":95.76104292,"intensity":82.090385437},{"mz":95.8893777,"intensity":116.7808609009},{"mz":96.20699297,"intensity":87.2718429565},{"mz":97.74748656,"intensity":88.9470748901},{"mz":98.34356799,"intensity":87.3619918823},{"mz":98.49292658,"intensity":85.9323043823},{"mz":100.5078718,"intensity":84.2070922852},{"mz":100.9337281,"intensity":338.9331970215},{"mz":101.0645353,"intensity":123.107635498},{"mz":101.2161591,"intensity":91.7798080444},{"mz":101.2790282,"intensity":95.0563583374},{"mz":102.1040741,"intensity":80.4088516235},{"mz":103.2657316,"intensity":95.5047149658},{"mz":103.4021243,"intensity":88.4774169922},{"mz":103.6391983,"intensity":79.8376922607},{"mz":104.2972329,"intensity":83.7552032471},{"mz":106.3499645,"intensity":85.2879943848},{"mz":106.4638673,"intensity":98.9561309814},{"mz":107.6467802,"intensity":99.3282623291},{"mz":109.0660667,"intensity":745.5578613281},{"mz":109.4761856,"intensity":89.0104293823},{"mz":111.0459277,"intensity":99.1397628784},{"mz":111.3734955,"intensity":86.5831298828},{"mz":112.1524279,"intensity":96.8014450073},{"mz":115.0395228,"intensity":86.0279006958},{"mz":117.0863767,"intensity":95.4297409058},{"mz":117.2947645,"intensity":86.8316802979},{"mz":117.8871062,"intensity":101.0641555786},{"mz":119.7902868,"intensity":88.0967788696},{"mz":123.2295384,"intensity":92.3214950562},{"mz":123.2492273,"intensity":80.7161254883},{"mz":124.0963102,"intensity":85.0089035034},{"mz":124.4393261,"intensity":103.1517944336},{"mz":124.5797019,"intensity":92.6791229248},{"mz":126.3358485,"intensity":91.8856201172},{"mz":127.3987696,"intensity":110.1672668457},{"mz":128.2671667,"intensity":89.9317321777},{"mz":128.7188748,"intensity":97.9682617188},{"mz":129.0559177,"intensity":4074.9223632813},{"mz":129.3847403,"intensity":88.2188949585},{"mz":129.5173458,"intensity":77.4944000244},{"mz":130.0014789,"intensity":95.1460113525},{"mz":130.4414397,"intensity":84.860824585},{"mz":130.566187,"intensity":91.2948226929},{"mz":131.7923317,"intensity":93.1785736084},{"mz":132.0425275,"intensity":97.5043411255},{"mz":133.0733767,"intensity":87.7209854126},{"mz":133.1836333,"intensity":100.8597793579},{"mz":133.9913128,"intensity":94.8503952026},{"mz":135.2296531,"intensity":92.3200149536},{"mz":135.7029071,"intensity":86.4309539795},{"mz":138.4051763,"intensity":93.9072189331},{"mz":141.0561055,"intensity":143.7358856201},{"mz":144.6108336,"intensity":89.2325439453},{"mz":144.9236277,"intensity":100.2202072144},{"mz":148.7582263,"intensity":105.2370452881},{"mz":149.2920133,"intensity":91.2032699585},{"mz":153.5445525,"intensity":104.1114654541},{"mz":155.0716043,"intensity":5602.8383789063},{"mz":155.2145031,"intensity":92.2022628784},{"mz":156.1720865,"intensity":97.0802230835},{"mz":161.2926177,"intensity":96.6881484985},{"mz":163.1494552,"intensity":687.2802734375},{"mz":165.3464434,"intensity":97.0835876465},{"mz":175.1490554,"intensity":222.6409301758},{"mz":175.8006777,"intensity":88.4362716675},{"mz":180.8429789,"intensity":92.7274856567},{"mz":181.1297526,"intensity":92.4441833496},{"mz":181.3166072,"intensity":90.1677017212},{"mz":182.2010177,"intensity":87.8263549805},{"mz":185.294159,"intensity":102.6330337524},{"mz":191.7127173,"intensity":87.0380325317},{"mz":197.6343024,"intensity":92.254699707},{"mz":199.3380078,"intensity":99.7384719849},{"mz":200.0354938,"intensity":91.5852355957},{"mz":203.1808278,"intensity":1858.9030761719},{"mz":216.2713788,"intensity":93.8675003052},{"mz":217.121773,"intensity":99.9596557617},{"mz":221.0579628,"intensity":96.8034973145},{"mz":222.149152,"intensity":96.8045425415},{"mz":224.0618964,"intensity":93.5916748047},{"mz":227.2413451,"intensity":102.4233551025},{"mz":230.3160226,"intensity":103.3617858887},{"mz":231.2128356,"intensity":90.4426422119},{"mz":237.6200177,"intensity":91.1145935059},{"mz":243.1732358,"intensity":103.0662689209},{"mz":244.8234281,"intensity":1474.7277832031},{"mz":245.1911466,"intensity":114.5413818359},{"mz":254.9548063,"intensity":99.8152770996},{"mz":255.2121456,"intensity":135.9027404785},{"mz":257.1917881,"intensity":96.9233856201},{"mz":264.5333552,"intensity":91.9348831177},{"mz":266.1026053,"intensity":97.4691848755},{"mz":272.5308618,"intensity":88.8196334839},{"mz":273.2229372,"intensity":1905.8353271484},{"mz":275.0037423,"intensity":94.4415817261},{"mz":275.3921288,"intensity":87.3567886353},{"mz":277.4098863,"intensity":100.8474502563},{"mz":280.6369066,"intensity":97.3751449585},{"mz":281.262057,"intensity":90.4207611084},{"mz":281.5615722,"intensity":102.8544464111},{"mz":284.4939783,"intensity":104.6832351685},{"mz":292.405233,"intensity":88.6916656494},{"mz":299.2985725,"intensity":92.58934021},{"mz":300.9914664,"intensity":89.5721206665},{"mz":302.0850496,"intensity":94.9493713379},{"mz":312.2499063,"intensity":116.0407714844},{"mz":316.518931,"intensity":87.4389190674},{"mz":317.2128556,"intensity":2891.2561035156},{"mz":324.6633422,"intensity":100.8535385132},{"mz":327.3021367,"intensity":95.3227386475},{"mz":330.5189216,"intensity":100.2180938721},{"mz":331.067212,"intensity":87.6555480957},{"mz":334.7975732,"intensity":98.1839904785},{"mz":335.2235195,"intensity":2368.6931152344},{"mz":337.7197712,"intensity":112.133605957},{"mz":338.9233758,"intensity":96.336151123},{"mz":342.8254592,"intensity":95.7562103271},{"mz":344.083898,"intensity":92.0450744629},{"mz":352.0979638,"intensity":95.5995178223},{"mz":357.2904358,"intensity":100.7388000488}]
Structure
Common name
5-HPETE
LMID
Systematic name
5-hydroperoxyeicosa-6E,8Z,11Z,14Z-tetraenoic acid
m/z
335.2228
Adduct / Ion
[M-H]-
Charge
-1
Ion source
HESI
Instrument
Thermo Scientific Orbitrap Exploris 240
Resolution
30000
For high resolution data only
Ion mode
Negative
Collision Energy (CE)
17,27,37
Column
Accucore C30 150 x 2.1
Mobile phase A
Acetonitrile:water 50/50 v/v 5mM AmFm + 0.1% FA
Mobile phase B
Isopropanol:Acetonitrile:water 85/10/5 v/v 5mM AmFm + 0.1% FA
Retention time (min)
6.98
Amount injected
25 pmol
DOI for method
Date acquired
March 2025
Submitters
Fedorova Lab (LMAI) - Gabriele Lombardi Bendoula
Source of standard
Cayman
5-HPETE
Thermo Scientific Orbitrap Exploris 240
[M-H]-
Fedorova Lab (LMAI) - Gabriele Lombardi Bendoula
[{"mz":50.66335106,"intensity":238.5642242432},{"mz":51.10744343,"intensity":205.6971130371},{"mz":52.85678447,"intensity":240.931060791},{"mz":54.52559537,"intensity":254.6190490723},{"mz":55.33539511,"intensity":226.8341064453},{"mz":56.24551308,"intensity":253.0345458984},{"mz":57.0346666,"intensity":328.8460998535},{"mz":58.07235468,"intensity":251.1700286865},{"mz":59.01219152,"intensity":288.0042419434},{"mz":59.01390464,"intensity":2761.3134765625},{"mz":61.57211745,"intensity":216.4008636475},{"mz":63.83753932,"intensity":224.882232666},{"mz":68.09328162,"intensity":251.3217010498},{"mz":70.28178601,"intensity":228.3568725586},{"mz":70.77332698,"intensity":221.6728973389},{"mz":71.01395588,"intensity":706.742980957},{"mz":72.25368187,"intensity":234.0324249268},{"mz":74.59018499,"intensity":235.911026001},{"mz":75.05411315,"intensity":219.5513000488},{"mz":75.37330613,"intensity":318.3424682617},{"mz":76.4029445,"intensity":229.8349304199},{"mz":78.35165771,"intensity":222.0437164307},{"mz":79.19327482,"intensity":267.2816772461},{"mz":79.39658796,"intensity":232.0344543457},{"mz":79.54976335,"intensity":225.1792297363},{"mz":83.0504062,"intensity":317.2817687988},{"mz":83.36597023,"intensity":208.178604126},{"mz":83.37055543,"intensity":215.4709320068},{"mz":85.80029973,"intensity":263.9253234863},{"mz":89.35692615,"intensity":244.1589355469},{"mz":89.87026162,"intensity":238.2155151367},{"mz":93.07061924,"intensity":212.674911499},{"mz":95.68446559,"intensity":231.8104095459},{"mz":96.59896458,"intensity":235.0010986328},{"mz":96.95971474,"intensity":214.2516174316},{"mz":97.59652588,"intensity":207.5437316895},{"mz":98.2785091,"intensity":205.6892852783},{"mz":98.92491103,"intensity":232.8550872803},{"mz":101.2168655,"intensity":281.0066833496},{"mz":101.2454128,"intensity":249.5735015869},{"mz":101.7815576,"intensity":203.5364379883},{"mz":102.0878849,"intensity":218.6579284668},{"mz":106.6600288,"intensity":208.9478759766},{"mz":108.4347668,"intensity":242.5543823242},{"mz":112.9858583,"intensity":330.8352355957},{"mz":116.9289223,"intensity":290.8111877441},{"mz":118.7733999,"intensity":222.7273712158},{"mz":121.5791825,"intensity":219.1340026855},{"mz":122.14208,"intensity":212.1263580322},{"mz":129.0560627,"intensity":2107.2629394531},{"mz":129.7057104,"intensity":278.7577514648},{"mz":130.1326984,"intensity":231.4898986816},{"mz":133.8980379,"intensity":221.4661102295},{"mz":137.8927022,"intensity":311.2261962891},{"mz":138.8906659,"intensity":283.3992004395},{"mz":139.9084609,"intensity":2176.6010742188},{"mz":140.4040257,"intensity":232.3338165283},{"mz":142.1456765,"intensity":218.7029571533},{"mz":142.3321546,"intensity":213.6646575928},{"mz":145.3096853,"intensity":234.5013122559},{"mz":155.0717297,"intensity":2560.0095214844},{"mz":156.8558209,"intensity":236.1722869873},{"mz":162.1131664,"intensity":229.459777832},{"mz":164.7644082,"intensity":237.674987793},{"mz":175.041885,"intensity":242.8598022461},{"mz":176.5400199,"intensity":224.352355957},{"mz":179.1883254,"intensity":270.5203552246},{"mz":183.89827,"intensity":908.2315063477},{"mz":198.8418375,"intensity":264.4899902344},{"mz":201.0429887,"intensity":254.937713623},{"mz":201.1652429,"intensity":333.1811523438},{"mz":201.7196677,"intensity":249.3060760498},{"mz":206.8445629,"intensity":252.1290435791},{"mz":206.909173,"intensity":239.4739837646},{"mz":210.6447617,"intensity":237.1252441406},{"mz":215.8037351,"intensity":265.5128173828},{"mz":231.0663757,"intensity":228.6772003174},{"mz":233.1492625,"intensity":222.1044311523},{"mz":242.8248081,"intensity":300.3671264648},{"mz":243.5342949,"intensity":230.49168396},{"mz":252.2820342,"intensity":259.5127868652},{"mz":265.148937,"intensity":286.3673095703},{"mz":270.3471734,"intensity":260.6935119629},{"mz":271.2067613,"intensity":270.9668579102},{"mz":281.0804042,"intensity":262.9685974121},{"mz":299.0088762,"intensity":234.575378418},{"mz":301.0532011,"intensity":222.752746582},{"mz":315.1979844,"intensity":236.2714538574},{"mz":315.9481305,"intensity":229.0199890137},{"mz":352.4830774,"intensity":231.1251220703},{"mz":355.5247393,"intensity":256.7987060547}]
Structure
Common name
5-HPETE
LMID
Systematic name
5-hydroperoxyeicosa-6E,8Z,11Z,14Z-tetraenoic acid
m/z
335.2228
Adduct / Ion
[M-H]-
Charge
-1
Ion source
HESI
Instrument
Thermo Scientific Orbitrap Exploris 240
Resolution
30000
For high resolution data only
Ion mode
Negative
Collision Energy (CE)
17,27,37
Column
Accucore C30 150 x 2.1
Mobile phase A
Acetonitrile:water 50/50 v/v 5mM AmFm + 0.1% FA
Mobile phase B
Isopropanol:Acetonitrile:water 85/10/5 v/v 5mM AmFm + 0.1% FA
Amount injected
25 pmol
DOI for method
Date acquired
March 2025
Submitters
Fedorova Lab (LMAI) - Gabriele Lombardi Bendoula
Source of standard
Cayman
5-HPETE
Thermo Scientific Orbitrap Exploris 240
[M-H2O-H]-
Fedorova Lab (LMAI) - Gabriele Lombardi Bendoula
[{"mz":57.03463364,"intensity":18633.484375},{"mz":57.06851196,"intensity":2035.7144775391},{"mz":59.01386642,"intensity":161983.25},{"mz":65.03974915,"intensity":2893.7275390625},{"mz":69.03469086,"intensity":14915.8759765625},{"mz":70.31121063,"intensity":1438.7219238281},{"mz":71.01387024,"intensity":43870.00390625},{"mz":74.41403961,"intensity":1838.9155273438},{"mz":83.05017853,"intensity":7910.6166992188},{"mz":85.06584167,"intensity":8286.634765625},{"mz":93.07112885,"intensity":2559.8811035156},{"mz":95.05046082,"intensity":2718.181640625},{"mz":107.0868454,"intensity":3374.3901367188},{"mz":109.0658798,"intensity":15795.2158203125},{"mz":109.102562,"intensity":1719.1323242188},{"mz":111.045166,"intensity":9223.578125},{"mz":111.0816727,"intensity":3204.9230957031},{"mz":111.5937729,"intensity":1541.12890625},{"mz":113.0244293,"intensity":17642.26171875},{"mz":118.2498169,"intensity":1481.7420654297},{"mz":121.0659637,"intensity":4756.6752929688},{"mz":121.1022491,"intensity":10458.8154296875},{"mz":123.0816345,"intensity":8931.9462890625},{"mz":123.9446259,"intensity":1591.8920898438},{"mz":124.8003998,"intensity":1419.5516357422},{"mz":129.0557861,"intensity":87829.6328125},{"mz":133.1022491,"intensity":7411.26171875},{"mz":135.0814056,"intensity":1989.9489746094},{"mz":135.1179199,"intensity":5399.638671875},{"mz":141.0559235,"intensity":8000.447265625},{"mz":147.1179657,"intensity":57492.79296875},{"mz":147.1253815,"intensity":2817.0231933594},{"mz":149.0973663,"intensity":3749.9140625},{"mz":149.13414,"intensity":2597.2761230469},{"mz":153.055603,"intensity":12553.89453125},{"mz":155.0715485,"intensity":24454.44140625},{"mz":161.133606,"intensity":24814.478515625},{"mz":163.1129303,"intensity":6979.1748046875},{"mz":163.1494751,"intensity":2247.7087402344},{"mz":165.055481,"intensity":3913.4306640625},{"mz":165.8376923,"intensity":1509.1434326172},{"mz":167.0713806,"intensity":22390.693359375},{"mz":173.1336823,"intensity":45537.89453125},{"mz":175.113205,"intensity":2342.1296386719},{"mz":175.1487732,"intensity":2817.2595214844},{"mz":179.0714874,"intensity":5913.0390625},{"mz":179.7252502,"intensity":1637.0853271484},{"mz":181.0869904,"intensity":9168.0107421875},{"mz":193.0868988,"intensity":3121.435546875},{"mz":194.094696,"intensity":5679.6176757813},{"mz":195.1023712,"intensity":2081.1787109375},{"mz":201.1649628,"intensity":66627.1640625},{"mz":202.1368408,"intensity":3708.3920898438},{"mz":203.1815033,"intensity":2489.5114746094},{"mz":205.0863495,"intensity":2270.49609375},{"mz":205.8526154,"intensity":1779.4409179688},{"mz":207.1019287,"intensity":3973.7165527344},{"mz":219.1019287,"intensity":2407.3220214844},{"mz":220.1104736,"intensity":3843.26953125},{"mz":225.1650848,"intensity":2621.7663574219},{"mz":237.1500549,"intensity":4570.0551757813},{"mz":243.1753998,"intensity":13639.5517578125},{"mz":247.375885,"intensity":1505.8841552734},{"mz":253.1961823,"intensity":12987.0830078125},{"mz":255.1753998,"intensity":6809.1284179688},{"mz":271.2068176,"intensity":47230.44140625},{"mz":297.1861877,"intensity":26265.44921875},{"mz":315.1965942,"intensity":447742.34375},{"mz":316.1993713,"intensity":5088.1635742188}]
Structure
Common name
5-HPETE
LMID
Systematic name
5-hydroperoxyeicosa-6E,8Z,11Z,14Z-tetraenoic acid
m/z
317.2122
Adduct / Ion
[M-H2O-H]-
Charge
-1
Ion source
HESI
Instrument
Thermo Scientific Orbitrap Exploris 240
Resolution
30000
For high resolution data only
Ion mode
Negative
Collision Energy (CE)
17,27,37
Column
Accucore C30 150 x 2.1
Mobile phase A
Acetonitrile:water 50/50 v/v 5mM AmFm + 0.1% FA
Mobile phase B
Isopropanol:Acetonitrile:water 85/10/5 v/v 5mM AmFm + 0.1% FA
Amount injected
25 pmol
DOI for method
Date acquired
March 2025
Submitters
Fedorova Lab (LMAI) - Gabriele Lombardi Bendoula
Source of standard
Cayman