| SpectraBase Spectrum ID |
DmVuIdzxHC9 |
| Name |
4'-Cyanophthalanilic acid |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
266.069142187 u |
| Formula |
C15H10N2O3 |
| InChI |
InChI=1S/C15H10N2O3/c16-9-10-5-7-11(8-6-10)17-14(18)12-3-1-2-4-13(12)15(19)20/h1-8H,(H,17,18)(H,19,20) |
| InChIKey |
UJQQFTZEYPBVHS-UHFFFAOYSA-N |
| Molecular Weight |
266.256 g/mol |
| SMILES |
N(C(C=1C(C(=O)O)=CC=CC1)=O)C=1C=CC(=CC1)C#N |
| Spectrum/Structure Validation Score (Raman) |
0.945644 |
