CID 76290
Octadecyl dihydrogen phosphate
Structural Information
- Molecular Formula
- C18H39O4P
- SMILES
- CCCCCCCCCCCCCCCCCCOP(=O)(O)O
- InChI
- InChI=1S/C18H39O4P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-23(19,20)21/h2-18H2,1H3,(H2,19,20,21)
- InChIKey
- UHGIMQLJWRAPLT-UHFFFAOYSA-N
- Compound name
- octadecyl dihydrogen phosphate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 351.26588 | 198.7 |
[M+Na]+ | 373.24782 | 200.1 |
[M-H]- | 349.25132 | 192.7 |
[M+NH4]+ | 368.29242 | 189.5 |
[M+K]+ | 389.22176 | 196.5 |
[M+H-H2O]+ | 333.25586 | 189.9 |
[M+HCOO]- | 395.25680 | 207.7 |
[M+CH3COO]- | 409.27245 | 212.5 |
[M+Na-2H]- | 371.23327 | 195.7 |
[M]+ | 350.25805 | 206.9 |
[M]- | 350.25915 | 206.9 |