SpectraBase Spectrum ID |
7HJwuZ5yF79 |
Name |
2-(3-(4-Hydroxybenzoyl)phenyl)propionicacid methyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
284.104858991 u |
Formula |
C17H16O4 |
InChI |
InChI=1S/C17H16O4/c1-11(17(20)21-2)13-4-3-5-14(10-13)16(19)12-6-8-15(18)9-7-12/h3-11,18H,1-2H3 |
InChIKey |
HUEPRCAJXIOEHP-UHFFFAOYSA-N |
SMILES |
C(C(C)C1=CC(=CC=C1)C(C1=CC=C(C=C1)O)=O)(=O)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.950353 |