SpectraBase Spectrum ID |
FKHurMuCsjX |
Name |
Benzene, 4-[(2,2-dibromocyclopropyl)methyl]-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/c1-15-10-4-3-8(6-11(10)16-2)5-9-7-12(9,13)14/h3-4,6,9H,5,7H2,1-2H3 |
InChIKey |
ILOCKRWSJXAJPE-UHFFFAOYSA-N |
Molecular Weight |
350.050 g/mol |
SMILES |
C1(=CC(=CC=C1OC)CC1C(Br)(Br)C1)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.966223 |