| SpectraBase Spectrum ID |
6ZSFHCLIGyq |
| Name |
(2S)-2-Ethoxy-2-phenyl-acetic acid |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
180.078644243 u |
| Formula |
C10H12O3 |
| InChI |
InChI=1S/C10H12O3/c1-2-13-9(10(11)12)8-6-4-3-5-7-8/h3-7,9H,2H2,1H3,(H,11,12)/t9-/m0/s1 |
| InChIKey |
XBLYVSAKBBNYDO-VIFPVBQESA-N |
| Molecular Weight |
180.203 g/mol |
| SMILES |
C([C@](C1=CC=CC=C1)(OCC)[H])(=O)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.964219 |
