| SpectraBase Spectrum ID |
HdcnKVTPIG2 |
| Name |
4-Hydroxy-2-benzylidene butanoic acid |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
192.078644243 u |
| Formula |
C11H12O3 |
| InChI |
InChI=1S/C11H12O3/c12-7-6-10(11(13)14)8-9-4-2-1-3-5-9/h1-5,8,12H,6-7H2,(H,13,14)/b10-8+ |
| InChIKey |
QLXNTJSZOZSKFD-CSKARUKUSA-N |
| Molecular Weight |
192.214 g/mol |
| SMILES |
C(\C(=C\C1=CC=CC=C1)CCO)(=O)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.933901 |
