CID 247653
36847-94-6
Structural Information
- Molecular Formula
- C11H11NO4
- SMILES
- COC1=CC=CC=C1NC(=O)C=CC(=O)O
- InChI
- InChI=1S/C11H11NO4/c1-16-9-5-3-2-4-8(9)12-10(13)6-7-11(14)15/h2-7H,1H3,(H,12,13)(H,14,15)
- InChIKey
- HGLMERMZXFKZOL-UHFFFAOYSA-N
- Compound name
- 4-(2-methoxyanilino)-4-oxobut-2-enoic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 222.07608 | 146.7 |
[M+Na]+ | 244.05802 | 153.1 |
[M-H]- | 220.06152 | 149.0 |
[M+NH4]+ | 239.10262 | 163.8 |
[M+K]+ | 260.03196 | 151.1 |
[M+H-H2O]+ | 204.06606 | 140.3 |
[M+HCOO]- | 266.06700 | 169.6 |
[M+CH3COO]- | 280.08265 | 186.9 |
[M+Na-2H]- | 242.04347 | 150.5 |
[M]+ | 221.06825 | 147.3 |
[M]- | 221.06935 | 147.3 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.