| SpectraBase Compound ID | AYP2geIRXqw |
|---|---|
| InChI | InChI=1S/C9H10O3/c1-12-9(11)6-7-4-2-3-5-8(7)10/h2-5,10H,6H2,1H3 |
| InChIKey | BVBSGGBDFJUSIH-UHFFFAOYSA-N |
| Mol Weight | 166.18 g/mol |
| Molecular Formula | C9H10O3 |
| Exact Mass | 166.062994 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | KxfwKrYUUnK |
|---|---|
| Name | (o-Hydroxyphenyl)acetic acid, methyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 166.062994179 u |
| Formula | C9H10O3 |
| InChI | InChI=1S/C9H10O3/c1-12-9(11)6-7-4-2-3-5-8(7)10/h2-5,10H,6H2,1H3 |
| InChIKey | BVBSGGBDFJUSIH-UHFFFAOYSA-N |
| SMILES | OC=1C(=CC=CC1)CC(OC)=O |
| Spectrum/Structure Validation Score (Raman) | 0.946771 |