CID 5313789
Pc(34:0/16:0)
Structural Information
- Molecular Formula
- C58H117NO8P
- SMILES
- CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)(O)OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCC
- InChI
- InChI=1S/C58H116NO8P/c1-6-8-10-12-14-16-18-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-39-40-42-44-46-48-50-57(60)64-54-56(55-66-68(62,63)65-53-52-59(3,4)5)67-58(61)51-49-47-45-43-41-38-19-17-15-13-11-9-7-2/h56H,6-55H2,1-5H3/p+1/t56-/m1/s1
- InChIKey
- JWUPPWAREFIPKZ-LXXIDKMWSA-O
- Compound name
- 2-[[(2R)-2-hexadecanoyloxy-3-tetratriacontanoyloxypropoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 987.85898 | 338.0 |
[M+Na]+ | 1009.8409 | 336.3 |
[M-H]- | 985.84442 | 325.0 |
[M+NH4]+ | 1004.8855 | 345.9 |
[M+K]+ | 1025.8149 | 346.2 |
[M+H-H2O]+ | 969.84896 | 321.7 |
[M+HCOO]- | 1031.8499 | 336.4 |
[M+CH3COO]- | 1045.8656 | 328.9 |
[M+Na-2H]- | 1007.8264 | 310.5 |
[M]+ | 986.85115 | 338.6 |
[M]- | 986.85225 | 338.6 |
Literature stripe
No literature data available for this compound.