| SpectraBase Spectrum ID |
4L7n2gWdIoW |
| Name |
4-{[3-(4-Chlorophenyl)-3-hydroxy-2-propenylidene]amino}benzoic acid |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
301.050570947 u |
| Formula |
C16H12ClNO3 |
| InChI |
InChI=1S/C16H12ClNO3/c17-13-5-1-11(2-6-13)15(19)9-10-18-14-7-3-12(4-8-14)16(20)21/h1-10,19H,(H,20,21)/b15-9-,18-10+ |
| InChIKey |
SDKKKMTZHRBJMN-PFVOVTSXSA-N |
| Molecular Weight |
301.729 g/mol |
| SMILES |
C(C=1C=CC(\N=C\C=C\(C=2C=CC(=CC2)Cl)O)=CC1)(=O)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.834538 |
![4-{[3-(4-Chlorophenyl)-3-hydroxy-2-propenylidene]amino}benzoic acid](/api/spectrum/4L7n2gWdIoW/structure.png?h=300&w=458 "4-{[3-(4-Chlorophenyl)-3-hydroxy-2-propenylidene]amino}benzoic acid")
