CID 87383073
2-keto-4-hydroxy-5-phosphopentanoate
Structural Information
- Molecular Formula
- C5H9O7P
- SMILES
- C(C(CP(=O)(O)O)O)C(=O)C(=O)O
- InChI
- InChI=1S/C5H9O7P/c6-3(2-13(10,11)12)1-4(7)5(8)9/h3,6H,1-2H2,(H,8,9)(H2,10,11,12)
- InChIKey
- FHTJZANAUHFQCD-UHFFFAOYSA-N
- Compound name
- 4-hydroxy-2-oxo-5-phosphonopentanoic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 213.01587 | 142.5 |
[M+Na]+ | 234.99781 | 147.9 |
[M-H]- | 211.00131 | 136.2 |
[M+NH4]+ | 230.04241 | 158.3 |
[M+K]+ | 250.97175 | 147.9 |
[M+H-H2O]+ | 195.00585 | 136.3 |
[M+HCOO]- | 257.00679 | 163.3 |
[M+CH3COO]- | 271.02244 | 175.9 |
[M+Na-2H]- | 232.98326 | 142.2 |
[M]+ | 212.00804 | 142.8 |
[M]- | 212.00914 | 142.8 |