SpectraBase Spectrum ID |
2RndQAznK7u |
Name |
Benzene, 4-[2-(dibromomethyl)-2-propenyl]-1,2-dimethoxy- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
347.936055689 u |
Formula |
C12H14Br2O2 |
InChI |
InChI=1S/C12H14Br2O2/c1-8(12(13)14)6-9-4-5-10(15-2)11(7-9)16-3/h4-5,7,12H,1,6H2,2-3H3 |
InChIKey |
JDQPEEQYYYRAGX-UHFFFAOYSA-N |
Molecular Weight |
350.050 g/mol |
SMILES |
C1(=CC(=CC=C1OC)CC(=C)C(Br)Br)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.94683 |