SpectraBase Spectrum ID |
DHcKx1WeyRj |
Name |
1-Benzoxy-5-bromo-4-(bromomethyl)-2-methoxy-benzene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
383.936055689 u |
Formula |
C15H14Br2O2 |
InChI |
InChI=1S/C15H14Br2O2/c1-18-14-7-12(9-16)13(17)8-15(14)19-10-11-5-3-2-4-6-11/h2-8H,9-10H2,1H3 |
InChIKey |
HHYLHSWRJNEKRY-UHFFFAOYSA-N |
Molecular Weight |
386.083 g/mol |
SMILES |
C=1(C(=CC(=C(C1)Br)CBr)OC)OCC=1C=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.916771 |