CID 131839775
Methyl 15,16-dihydroxy-tetracosanoate
Structural Information
- Molecular Formula
- C25H50O4
- SMILES
- CCCCCCCCC(C(CCCCCCCCCCCCCC(=O)OC)O)O
- InChI
- InChI=1S/C25H50O4/c1-3-4-5-6-14-17-20-23(26)24(27)21-18-15-12-10-8-7-9-11-13-16-19-22-25(28)29-2/h23-24,26-27H,3-22H2,1-2H3
- InChIKey
- ANKIJNMJOZDVJY-UHFFFAOYSA-N
- Compound name
- methyl 15,16-dihydroxytetracosanoate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 415.37818 | 217.5 |
[M+Na]+ | 437.36012 | 215.4 |
[M-H]- | 413.36362 | 211.4 |
[M+NH4]+ | 432.40472 | 215.7 |
[M+K]+ | 453.33406 | 211.4 |
[M+H-H2O]+ | 397.36816 | 209.6 |
[M+HCOO]- | 459.36910 | 220.3 |
[M+CH3COO]- | 473.38475 | 227.1 |
[M+Na-2H]- | 435.34557 | 209.8 |
[M]+ | 414.37035 | 225.1 |
[M]- | 414.37145 | 225.1 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.