| SpectraBase Spectrum ID |
E3V4y377cKI |
| Name |
2-Bromanyl-N-[4-(4-chloranylphenoxy)phenyl]-3,4,5-trimethoxy-benzamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
491.013513411 u |
| Formula |
C22H19BrClNO5 |
| InChI |
InChI=1S/C22H19BrClNO5/c1-27-18-12-17(19(23)21(29-3)20(18)28-2)22(26)25-14-6-10-16(11-7-14)30-15-8-4-13(24)5-9-15/h4-12H,1-3H3,(H,25,26) |
| InChIKey |
GFLNFSVBOZCKPQ-UHFFFAOYSA-N |
| Molecular Weight |
492.753 g/mol |
| SMILES |
C=1(C(NC2=CC=C(OC=3C=CC(=CC3)Cl)C=C2)=O)C(=C(OC)C(=C(C1)OC)OC)Br |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.940632 |
![2-Bromanyl-N-[4-(4-chloranylphenoxy)phenyl]-3,4,5-trimethoxy-benzamide](/api/spectrum/E3V4y377cKI/structure.png?h=300&w=458 "2-Bromanyl-N-[4-(4-chloranylphenoxy)phenyl]-3,4,5-trimethoxy-benzamide")
