Common Name
LM ID
Instrument
Adduct / Ion
Submitter
2,3-dinor-5,6-dihydro-15-F2t-IsoP
Thermo Scientific Q Exactive Focus Orbitrap LC-MS/MS System
[M-H]-
Jean-Marie Galano.Ángel Sánchez Illana.Thierry Durand
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Structure
Common name
2,3-dinor-5,6-dihydro-15-F2t-IsoP
LMID
Systematic name
9S,11R,15S-trihydroxy-2,3-dinor-13E-prostaenoic acid-cyclo[8S,12R]
m/z
327.2176
Adduct / Ion
[M-H]-
Charge
-1
Ion source
ESI
Instrument
Thermo Scientific Q Exactive Focus Orbitrap LC-MS/MS System
Resolution
17000
For high resolution data only
Ion mode
Negative
Collision Energy (CE)
30eV
Column
Kinetex EVO C18 (100 × 2.1 mm column 1.7 µm)
Mobile phase A
0.3 mL/min binary gradient using H2O (0.1% HCOOH)
Mobile phase B
CH3CN:CH3OH 8:2, (0.1% HCOOH)
Retention time (min)
7.57
Amount injected
5μl
DOI for method
Date acquired
October 2023
Submitters
Jean-Marie Galano.Ángel Sánchez Illana.Thierry Durand
Source of standard
Cayman
2,3-dinor-5,6-dihydro-15-F2t-IsoP
Thermo Fisher Orbitrap ID-X Tribrid
[M-H]-
Jean-Marie Galano.Ángel Sánchez Illana.Thierry Durand
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Structure
Common name
2,3-dinor-5,6-dihydro-15-F2t-IsoP
LMID
Systematic name
9S,11R,15S-trihydroxy-2,3-dinor-13E-prostaenoic acid-cyclo[8S,12R]
m/z
327.2177
Adduct / Ion
[M-H]-
Charge
-1
Ion source
ESI
Instrument
Thermo Fisher Orbitrap ID-X Tribrid
Resolution
60000
For high resolution data only
Ion mode
Negative
Collision Energy (CE)
stepped HCD collision energy 20–40–60%
Column
Kinetex C18 (100 × 2.1 mm, 1.7 µm)
Mobile phase A
H2O (0.1% HCOOH)
Mobile phase B
CH3CN (0.1% HCOOH) binary gradient at 0.5 m L/min
Retention time (min)
3.76
Amount injected
10 µL
DOI for method
Date acquired
October 2023
Submitters
Jean-Marie Galano.Ángel Sánchez Illana.Thierry Durand
Source of standard
Synthesized in-house
2,3-dinor-5,6-dihydro-15-F2t-IsoP
Thermo Fisher Orbitrap ID-X Tribrid
[M-H]-
Jean-Marie Galano.Ángel Sánchez Illana.Thierry Durand
[{"mz":59.0137,"intensity":390000},{"mz":69.0345,"intensity":32000},{"mz":71.0137,"intensity":45000},{"mz":83.0501,"intensity":27000},{"mz":85.0658,"intensity":88000},{"mz":97.0658,"intensity":31000},{"mz":99.0814,"intensity":73000},{"mz":109.0657,"intensity":22000},{"mz":111.0814,"intensity":110000},{"mz":113.0971,"intensity":75000},{"mz":137.0971,"intensity":84000},{"mz":139.1128,"intensity":110000},{"mz":147.1179,"intensity":59000},{"mz":155.1077,"intensity":76000},{"mz":165.0922,"intensity":28000},{"mz":165.1284,"intensity":73000},{"mz":167.1441,"intensity":210000},{"mz":181.1234,"intensity":21000},{"mz":183.1026,"intensity":200000},{"mz":185.1545,"intensity":43000},{"mz":191.1078,"intensity":100000},{"mz":193.1597,"intensity":170000},{"mz":203.1805,"intensity":28000},{"mz":209.1183,"intensity":210000},{"mz":221.1911,"intensity":160000},{"mz":229.1962,"intensity":91000},{"mz":237.186,"intensity":110000},{"mz":247.1709,"intensity":20000},{"mz":247.2067,"intensity":86000},{"mz":255.1963,"intensity":33000},{"mz":265.1811,"intensity":270000},{"mz":273.186,"intensity":66000},{"mz":283.1916,"intensity":1100000},{"mz":291.1967,"intensity":160000},{"mz":309.2073,"intensity":280000},{"mz":327.2179,"intensity":3700000}]
Structure
Common name
2,3-dinor-5,6-dihydro-15-F2t-IsoP
LMID
Systematic name
9S,11R,15S-trihydroxy-2,3-dinor-13E-prostaenoic acid-cyclo[8S,12R]
m/z
327.2177
Adduct / Ion
[M-H]-
Charge
-1
Ion source
ESI
Instrument
Thermo Fisher Orbitrap ID-X Tribrid
Resolution
60000
For high resolution data only
Ion mode
Negative
Collision Energy (CE)
stepped HCD collision energy 20–40–60%
Column
Kinetex C18 (100 × 2.1 mm, 1.7 µm)
Mobile phase A
H2O (0.1% HCOOH)
Mobile phase B
CH3CN (0.1% HCOOH) binary gradient at 0.5 m L/min
Retention time (min)
3.76
Amount injected
10 µL
DOI for method
Date acquired
October 2023
Submitters
Jean-Marie Galano.Ángel Sánchez Illana.Thierry Durand
Source of standard
Synthesized in-house
2,3-dinor-5,6-dihydro-15-F2t-IsoP
Waters Xevo TQ-XS Triple Quadrupole
[M-H]-
Wheelock/Hagn
[{"mz":54.73,"intensity":2702},{"mz":56.55,"intensity":9473},{"mz":58.85,"intensity":258400},{"mz":60.44,"intensity":1293},{"mz":65.3,"intensity":1830},{"mz":66.63,"intensity":2457},{"mz":68.31,"intensity":6925},{"mz":68.84,"intensity":67560},{"mz":70.81,"intensity":88770},{"mz":79.3,"intensity":2843},{"mz":80.26,"intensity":4033},{"mz":80.98,"intensity":7163},{"mz":81.89,"intensity":8111},{"mz":82.76,"intensity":54640},{"mz":84.87,"intensity":375900},{"mz":90.89,"intensity":11470},{"mz":92.53,"intensity":36440},{"mz":93.12,"intensity":46500},{"mz":94.78,"intensity":20990},{"mz":96.88,"intensity":68190},{"mz":98.86,"intensity":197700},{"mz":102.47,"intensity":1465},{"mz":104.53,"intensity":1381},{"mz":105.21,"intensity":12970},{"mz":106.67,"intensity":6629},{"mz":107.25,"intensity":443},{"mz":108.74,"intensity":51220},{"mz":109.37,"intensity":22670},{"mz":110.87,"intensity":256800},{"mz":112.92,"intensity":248300},{"mz":114.92,"intensity":3388},{"mz":118.61,"intensity":5622},{"mz":119.69,"intensity":8082},{"mz":120.95,"intensity":89710},{"mz":123.08,"intensity":61940},{"mz":124.39,"intensity":15530},{"mz":125.17,"intensity":23560},{"mz":126.97,"intensity":10860},{"mz":131.18,"intensity":7948},{"mz":132.15,"intensity":5393},{"mz":132.99,"intensity":31810},{"mz":134.37,"intensity":1992},{"mz":134.91,"intensity":15190},{"mz":136.94,"intensity":148100},{"mz":139.08,"intensity":279000},{"mz":140.67,"intensity":1640},{"mz":141.32,"intensity":11970},{"mz":142.89,"intensity":13290},{"mz":147,"intensity":455200},{"mz":147.93,"intensity":6095},{"mz":149.15,"intensity":36140},{"mz":151,"intensity":29780},{"mz":152.98,"intensity":51310},{"mz":154.92,"intensity":109200},{"mz":161.72,"intensity":4249},{"mz":162.41,"intensity":5740},{"mz":163.11,"intensity":73150},{"mz":164.97,"intensity":640900},{"mz":167.03,"intensity":759100},{"mz":170.92,"intensity":5245},{"mz":172.87,"intensity":42130},{"mz":174.96,"intensity":82960},{"mz":175.81,"intensity":3369},{"mz":176.47,"intensity":5610},{"mz":177.13,"intensity":13190},{"mz":180.96,"intensity":379200},{"mz":182.96,"intensity":831100},{"mz":185,"intensity":528200},{"mz":187.1,"intensity":26080},{"mz":188.12,"intensity":1909},{"mz":188.75,"intensity":2450},{"mz":190.98,"intensity":1296000},{"mz":192.98,"intensity":1224000},{"mz":194.96,"intensity":45530},{"mz":200.73,"intensity":6395},{"mz":201.32,"intensity":9569},{"mz":202.52,"intensity":17730},{"mz":203.07,"intensity":203700},{"mz":205.2,"intensity":18530},{"mz":205.97,"intensity":4798},{"mz":207.03,"intensity":3687},{"mz":209,"intensity":2071000},{"mz":210.96,"intensity":232100},{"mz":217.61,"intensity":5557},{"mz":218.4,"intensity":6454},{"mz":219.13,"intensity":57510},{"mz":221.05,"intensity":758000},{"mz":222.81,"intensity":2552},{"mz":223.34,"intensity":5186},{"mz":226.98,"intensity":108600},{"mz":229.1,"intensity":714900},{"mz":233.01,"intensity":4065},{"mz":234.61,"intensity":14060},{"mz":235.14,"intensity":77470},{"mz":237.01,"intensity":356700},{"mz":238.95,"intensity":156700},{"mz":243.34,"intensity":10180},{"mz":244.96,"intensity":33120},{"mz":247.06,"intensity":1199000},{"mz":250.99,"intensity":1657},{"mz":252.93,"intensity":21520},{"mz":254.95,"intensity":268000},{"mz":255.64,"intensity":6071},{"mz":260.99,"intensity":7458},{"mz":262.88,"intensity":174300},{"mz":263.45,"intensity":31830},{"mz":265,"intensity":3307000},{"mz":266.31,"intensity":6708},{"mz":268.35,"intensity":813},{"mz":272.9,"intensity":953300},{"mz":275.06,"intensity":728},{"mz":281.13,"intensity":22770},{"mz":282.97,"intensity":13010000},{"mz":288.94,"intensity":25660},{"mz":290.96,"intensity":2007000},{"mz":298.59,"intensity":690},{"mz":308.98,"intensity":2360000},{"mz":324.59,"intensity":2518},{"mz":326.97,"intensity":20450000}]
Structure
Common name
2,3-dinor-5,6-dihydro-15-F2t-IsoP
LMID
Systematic name
9S,11R,15S-trihydroxy-2,3-dinor-13E-prostaenoic acid-cyclo[8S,12R]
m/z
327.2
Adduct / Ion
[M-H]-
Charge
-1
Ion source
ESI
Instrument
Waters Xevo TQ-XS Triple Quadrupole
Resolution
N/A
For high resolution data only
Ion mode
Negative
Collision Energy (CE)
18
Column
Waters Acquity Premier BEH C18 with VanGuard FIT, 130 Å, 1.7 µm, 2.1 x 100 mm
Mobile phase A
Milli-Q H2O + 0.1 % (v/v) acetic acid
Mobile phase B
ACN:IPA (90:10)
Retention time (min)
1.55
Amount injected
0.25 ng
DOI for method
Date acquired
March 2025
Submitters
Wheelock/Hagn
Source of standard
Université de Montpellier (Durand/Galano/Oger)