| SpectraBase Spectrum ID |
9h5ysO6Eoge |
| Name |
N-[4-Bromo-2-(2-chlorobenzoyl)phenyl]-3,4,5-trimethoxibenzamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
503.013513411 u |
| Formula |
C23H19BrClNO5 |
| InChI |
InChI=1S/C23H19BrClNO5/c1-29-19-10-13(11-20(30-2)22(19)31-3)23(28)26-18-9-8-14(24)12-16(18)21(27)15-6-4-5-7-17(15)25/h4-12H,1-3H3,(H,26,28) |
| InChIKey |
MWRFLWTWNFGLNK-UHFFFAOYSA-N |
| Molecular Weight |
504.764 g/mol |
| SMILES |
C1=C(C=C(C(=C1OC)OC)OC)C(NC1=C(C=C(C=C1)Br)C(C=1C(Cl)=CC=CC1)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.910076 |
![N-[4-Bromo-2-(2-chlorobenzoyl)phenyl]-3,4,5-trimethoxibenzamide](/api/spectrum/9h5ysO6Eoge/structure.png?h=300&w=458 "N-[4-Bromo-2-(2-chlorobenzoyl)phenyl]-3,4,5-trimethoxibenzamide")
