LIPID MAPS® Ion Mobility Database
— Ion Mobility Data from the Unified CCS Compendium
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* CCS/z: collision cross section (A2) divided by charge (z) SD: standard deviation
| LMID | Name | m/z | Species | Charge | CCS/z (SD)* | Data source | DOI |
|---|---|---|---|---|---|---|---|
| LMST05020014 | Pregnenolone sulfate | 395.1910 | [M-H] | -1 | 206.2 (0) | McLean/MSMLS | 10.1021/acs.analchem.8b04322 |
| LMST05020015 | Sulfolithocholic Acid | 455.2467 | [M-H] | -1 | 211.14 (0.058) | PNNL/Baker | 10.1039/C7SC03464D |
| LMST05030001 | Glycocholic Acid | 488.2993 | [M+Na] | 1 | 202.2 (0.202) | McLean/MSMLS | 10.1021/acs.analchem.8b04322 |
| LMST05030001 | Glycocholic Acid | 504.2694 | [M+K] | 1 | 208 (0) | McLean/MSMLS | 10.1021/acs.analchem.8b04322 |
| LMST05030001 | Glycocholic Acid | 466.3162 | [M+H] | 1 | 199.7 (0.2) | McLean/MSMLS | 10.1021/acs.analchem.8b04322 |
| LMST05030001 | Glycocholic Acid | 544.2580 | [M-H] | -1 | 218.21 (0.058) | PNNL/Baker | 10.1039/C7SC03464D |
| LMST05030001 | Glycocholic Acid | 464.3060 | [M-H] | -1 | 202.2 (0) | McLean/MSMLS | 10.1021/acs.analchem.8b04322 |
| LMST05030006 | Glycodeoxycholic Acid | 528.2631 | [M-H] | -1 | 217.85 (0.154) | PNNL/Baker | 10.1039/C7SC03464D |
| LMST05030008 | Glycochenodeoxycholate | 448.3102 | [M-H] | -1 | 200.7 (0.201) | McLean/MSMLS | 10.1021/acs.analchem.8b04322 |
| LMST05030008 | Glycochenodeoxycholate | 472.3056 | [M+Na] | 1 | 203.6 (0) | McLean/MSMLS | 10.1021/acs.analchem.8b04322 |
| LMST05030008 | Glycochenodeoxycholate | 450.3205 | [M+H] | 1 | 196.8 (0.197) | McLean/MSMLS | 10.1021/acs.analchem.8b04322 |
| LMST05030009 | Glycolithocholic Acid | 512.2682 | [M-H] | -1 | 217.81 (0.209) | PNNL/Baker | 10.1039/C7SC03464D |
| LMST05040001 | Taurocholic Acid | 594.2407 | [M-H] | -1 | 220.88 (0.503) | PNNL/Baker | 10.1039/C7SC03464D |
| LMST05040005 | Taurochenodeoxycholic Acid | 578.2457 | [M-H] | -1 | 220.65 (0.819) | PNNL/Baker | 10.1039/C7SC03464D |
| LMST05040013 | Taurodeoxycholic Acid | 578.2458 | [M-H] | -1 | 220.68 (0.532) | PNNL/Baker | 10.1039/C7SC03464D |
| LMST05040018 | Lithocholyltaurine | 482.2954 | [M-H] | -1 | 206.56 (0.023) | McLean/MSMLS | 10.1021/acs.analchem.8b04322 |
| LMST05040018 | Lithocholyltaurine | 506.2897 | [M+Na] | 1 | 213.05 (0.291) | McLean/MSMLS | 10.1021/acs.analchem.8b04322 |
| - | SM(d36:1) | 753.5886 | [M+Na] | 1 | 288.12 (0.425) | McLean | 10.1021/ac4038448 |
| - | SM(d35:1) | 739.5730 | [M+Na] | 1 | 282.83 (0.368) | McLean | 10.1021/ac4038448 |
| - | SM(d34:1) | 725.5573 | [M+Na] | 1 | 280.97 (0.368) | McLean | 10.1021/ac4038448 |