![Benzoic acid, 5-[1-oxoethyl]-2-hydroxy-, methyl ester](/api/spectrum/DYf9swRZj8o/structure.png?h=300&w=458 "Benzoic acid, 5-[1-oxoethyl]-2-hydroxy-, methyl ester")
| SpectraBase Compound ID | 8ISsCfMRj0Q |
|---|---|
| InChI | InChI=1S/C10H10O4/c1-6(11)7-4-3-5-8(12)9(7)10(13)14-2/h3-5,12H,1-2H3 |
| InChIKey | ZEUFACDBGPVKQX-UHFFFAOYSA-N |
| Mol Weight | 194.19 g/mol |
| Molecular Formula | C10H10O4 |
| Exact Mass | 194.057909 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | DYf9swRZj8o |
|---|---|
| Name | Benzoic acid, 5-[1-oxoethyl]-2-hydroxy-, methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 194.057908798 u |
| Formula | C10H10O4 |
| InChI | InChI=1S/C10H10O4/c1-6(11)7-4-3-5-8(12)9(7)10(13)14-2/h3-5,12H,1-2H3 |
| InChIKey | ZEUFACDBGPVKQX-UHFFFAOYSA-N |
| Molecular Weight | 194.186 g/mol |
| SMILES | C1(=C(C(=CC=C1)C(C)=O)C(OC)=O)O |