SpectraBase Spectrum ID |
E7SjM04hmKO |
Name |
4-Hydroxy-2',5'-dichlorobiphenyl, methyl ether |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
252.010870341 u |
Formula |
C13H10Cl2O |
InChI |
InChI=1S/C13H10Cl2O/c1-16-11-5-2-9(3-6-11)12-8-10(14)4-7-13(12)15/h2-8H,1H3 |
InChIKey |
IXMGJMFERYKMCV-UHFFFAOYSA-N |
Molecular Weight |
253.128 g/mol |
SMILES |
C1(C2=C(C=CC(=C2)Cl)Cl)=CC=C(C=C1)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.876032 |