SpectraBase Spectrum ID |
DXxiFeCJfov |
Name |
Benzamide, 5-bromo-2-methoxy-N-(2-phenoxyethyl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
349.031356376 u |
Formula |
C16H16BrNO3 |
InChI |
InChI=1S/C16H16BrNO3/c1-20-15-8-7-12(17)11-14(15)16(19)18-9-10-21-13-5-3-2-4-6-13/h2-8,11H,9-10H2,1H3,(H,18,19) |
InChIKey |
AWFOROYNSADRQG-UHFFFAOYSA-N |
Molecular Weight |
350.212 g/mol |
SMILES |
C1=C(C(C(=O)NCCOC=2C=CC=CC2)=CC(=C1)Br)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.942426 |