| SpectraBase Compound ID | BSCzxiVMdLy |
|---|---|
| InChI | InChI=1S/C10H12O4/c1-13-10(12)9(11)7-14-8-5-3-2-4-6-8/h2-6,9,11H,7H2,1H3 |
| InChIKey | TWKBBKGZPALQOT-UHFFFAOYSA-N |
| Mol Weight | 196.2 g/mol |
| Molecular Formula | C10H12O4 |
| Exact Mass | 196.073559 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | Jno1fSQJf0S |
|---|---|
| Name | 3-(Phenyloxy)lactic acid methyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 196.073558862 u |
| Formula | C10H12O4 |
| InChI | InChI=1S/C10H12O4/c1-13-10(12)9(11)7-14-8-5-3-2-4-6-8/h2-6,9,11H,7H2,1H3 |
| InChIKey | TWKBBKGZPALQOT-UHFFFAOYSA-N |
| Molecular Weight | 196.202 g/mol |
| SMILES | C(C(COC=1C=CC=CC1)O)(=O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.969644 |