| SpectraBase Compound ID | 4ZAEC154Gc8 |
|---|---|
| InChI | InChI=1S/C13H11NO3/c14-9-6-7-11(12(15)8-9)13(16)17-10-4-2-1-3-5-10/h1-8,15H,14H2 |
| InChIKey | DNVVZWSVACQWJE-UHFFFAOYSA-N |
| Mol Weight | 229.23 g/mol |
| Molecular Formula | C13H11NO3 |
| Exact Mass | 229.073893 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | C3o5Q0klwwF |
|---|---|
| Name | 4-Aminosalicylic acid, phenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 229.073893215 u |
| Formula | C13H11NO3 |
| InChI | InChI=1S/C13H11NO3/c14-9-6-7-11(12(15)8-9)13(16)17-10-4-2-1-3-5-10/h1-8,15H,14H2 |
| InChIKey | DNVVZWSVACQWJE-UHFFFAOYSA-N |
| Molecular Weight | 229.235 g/mol |
| SMILES | NC=1C=CC(=C(C1)O)C(OC=1C=CC=CC1)=O |