CID 5280910
2,4-dihydroxyhept-2-enedioic acid
Structural Information
- Molecular Formula
- C7H10O6
- SMILES
- C(CC(=O)O)C(/C=C(/C(=O)O)\O)O
- InChI
- InChI=1S/C7H10O6/c8-4(1-2-6(10)11)3-5(9)7(12)13/h3-4,8-9H,1-2H2,(H,10,11)(H,12,13)/b5-3-
- InChIKey
- APNIDHDQYISZAE-HYXAFXHYSA-N
- Compound name
- (Z)-2,4-dihydroxyhept-2-enedioic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 191.05502 | 139.3 |
[M+Na]+ | 213.03696 | 144.1 |
[M-H]- | 189.04046 | 133.8 |
[M+NH4]+ | 208.08156 | 155.4 |
[M+K]+ | 229.01090 | 143.1 |
[M+H-H2O]+ | 173.04500 | 134.7 |
[M+HCOO]- | 235.04594 | 154.6 |
[M+CH3COO]- | 249.06159 | 172.8 |
[M+Na-2H]- | 211.02241 | 138.7 |
[M]+ | 190.04719 | 137.1 |
[M]- | 190.04829 | 137.1 |
Literature stripe
No literature data available for this compound.