CID 137323853
1-o-(2r-methoxy-4z-heneicosenyl)-sn-glycerol
Structural Information
- Molecular Formula
- C25H50O4
- SMILES
- CCCCCCCCCCCCCCCC/C=C\C[C@H](COC[C@H](CO)O)OC
- InChI
- InChI=1S/C25H50O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-25(28-2)23-29-22-24(27)21-26/h18-19,24-27H,3-17,20-23H2,1-2H3/b19-18-/t24-,25+/m0/s1
- InChIKey
- GVUUADGJHCLWTN-KLBCUTSMSA-N
- Compound name
- (2S)-3-[(Z,2R)-2-methoxyhenicos-4-enoxy]propane-1,2-diol
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 415.37818 | 216.6 |
[M+Na]+ | 437.36012 | 214.7 |
[M-H]- | 413.36362 | 210.4 |
[M+NH4]+ | 432.40472 | 214.8 |
[M+K]+ | 453.33406 | 210.2 |
[M+H-H2O]+ | 397.36816 | 208.5 |
[M+HCOO]- | 459.36910 | 223.3 |
[M+CH3COO]- | 473.38475 | 226.3 |
[M+Na-2H]- | 435.34557 | 210.1 |
[M]+ | 414.37035 | 224.9 |
[M]- | 414.37145 | 224.9 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.