SpectraBase Spectrum ID |
FbVD6vjaHMx |
Name |
1,2-bis(Chloromethyl)-4,5-dimethoxybenzene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
234.021435024 u |
Formula |
C10H12Cl2O2 |
InChI |
InChI=1S/C10H12Cl2O2/c1-13-9-3-7(5-11)8(6-12)4-10(9)14-2/h3-4H,5-6H2,1-2H3 |
InChIKey |
HBOBUTXJMIXYPE-UHFFFAOYSA-N |
Molecular Weight |
235.110 g/mol |
SMILES |
C1(=C(C=C(C(=C1)CCl)CCl)OC)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.958064 |