| SpectraBase Spectrum ID |
KCcv4xi9BNL |
| Name |
2-(3-Ethoxycarbonyloxyphenyl)acetic acid, methyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
238.084123546 u |
| Formula |
C12H14O5 |
| InChI |
InChI=1S/C12H14O5/c1-3-16-12(14)17-10-6-4-5-9(7-10)8-11(13)15-2/h4-7H,3,8H2,1-2H3 |
| InChIKey |
NNAMHZZZHZXKRB-UHFFFAOYSA-N |
| Molecular Weight |
238.239 g/mol |
| SMILES |
C(C(OC)=O)C1=CC(OC(OCC)=O)=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.958217 |
