CID 717662
3-[(ethoxycarbonyl)amino]benzoic acid
Structural Information
- Molecular Formula
- C10H11NO4
- SMILES
- CCOC(=O)NC1=CC=CC(=C1)C(=O)O
- InChI
- InChI=1S/C10H11NO4/c1-2-15-10(14)11-8-5-3-4-7(6-8)9(12)13/h3-6H,2H2,1H3,(H,11,14)(H,12,13)
- InChIKey
- ZLDHVJVKFNDXTH-UHFFFAOYSA-N
- Compound name
- 3-(ethoxycarbonylamino)benzoic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 210.07608 | 144.6 |
[M+Na]+ | 232.05802 | 154.4 |
[M+NH4]+ | 227.10262 | 150.6 |
[M+K]+ | 248.03196 | 150.5 |
[M-H]- | 208.06152 | 144.7 |
[M+Na-2H]- | 230.04347 | 149.0 |
[M]+ | 209.06825 | 145.5 |
[M]- | 209.06935 | 145.5 |