CID 61320440
6-(prop-2-enamido)pyridine-3-carboxylic acid
Structural Information
- Molecular Formula
- C9H8N2O3
- SMILES
- C=CC(=O)NC1=NC=C(C=C1)C(=O)O
- InChI
- InChI=1S/C9H8N2O3/c1-2-8(12)11-7-4-3-6(5-10-7)9(13)14/h2-5H,1H2,(H,13,14)(H,10,11,12)
- InChIKey
- DMGMCHVHBOINRJ-UHFFFAOYSA-N
- Compound name
- 6-(prop-2-enoylamino)pyridine-3-carboxylic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 193.06078 | 138.9 |
[M+Na]+ | 215.04272 | 146.2 |
[M-H]- | 191.04622 | 140.1 |
[M+NH4]+ | 210.08732 | 155.9 |
[M+K]+ | 231.01666 | 143.9 |
[M+H-H2O]+ | 175.05076 | 132.2 |
[M+HCOO]- | 237.05170 | 161.0 |
[M+CH3COO]- | 251.06735 | 182.0 |
[M+Na-2H]- | 213.02817 | 143.8 |
[M]+ | 192.05295 | 137.9 |
[M]- | 192.05405 | 137.9 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.