| SpectraBase Spectrum ID |
KXQa2kQ6LU7 |
| Name |
4'-Chloro-3,4,5-trimethoxybenzanilide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
321.076785695 u |
| Formula |
C16H16ClNO4 |
| InChI |
InChI=1S/C16H16ClNO4/c1-20-13-8-10(9-14(21-2)15(13)22-3)16(19)18-12-6-4-11(17)5-7-12/h4-9H,1-3H3,(H,18,19) |
| InChIKey |
ODRCEQRCKPMANV-UHFFFAOYSA-N |
| Molecular Weight |
321.760 g/mol |
| SMILES |
N(C(C1=CC(=C(C(=C1)OC)OC)OC)=O)C=1C=CC(=CC1)Cl |
| Spectrum/Structure Validation Score (Raman) |
0.976226 |