| SpectraBase Spectrum ID |
8jV8y8KRwC9 |
| Name |
2-Anilino-2',5'-dichloro-3-hydroxycrotonanilide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
336.043233097 u |
| Formula |
C16H14Cl2N2O2 |
| InChI |
InChI=1S/C16H14Cl2N2O2/c1-10(21)15(19-12-5-3-2-4-6-12)16(22)20-14-9-11(17)7-8-13(14)18/h2-9,19,21H,1H3,(H,20,22)/b15-10+ |
| InChIKey |
NBMQJKOGGQTGCT-XNTDXEJSSA-N |
| Molecular Weight |
337.206 g/mol |
| SMILES |
C\C(=C\(C(NC=1C=C(C=CC1Cl)Cl)=O)NC=1C=CC=CC1)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.903738 |
