SpectraBase Spectrum ID |
8EasVxnesVq |
Name |
2-(2-Bromophenyl)-N-(4-benzyloxy-2,3-dimethoxyphenethyl)acetamide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
483.104521317 u |
Formula |
C25H26BrNO4 |
InChI |
InChI=1S/C25H26BrNO4/c1-29-24-19(14-15-27-23(28)16-20-10-6-7-11-21(20)26)12-13-22(25(24)30-2)31-17-18-8-4-3-5-9-18/h3-13H,14-17H2,1-2H3,(H,27,28) |
InChIKey |
ABZCIIJGRLJJEW-UHFFFAOYSA-N |
Molecular Weight |
484.390 g/mol |
SMILES |
C1(=C(C(CCNC(CC=2C(Br)=CC=CC2)=O)=CC=C1OCC1=CC=CC=C1)OC)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.911444 |