SpectraBase Spectrum ID |
4JfN9cNbemT |
Name |
Benzenemethanol, 2-chloro-.alpha.-(4-chlorophenyl)-.alpha.-(trichloromethyl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
367.909603409 u |
Formula |
C14H9Cl5O |
InChI |
InChI=1S/C14H9Cl5O/c15-10-7-5-9(6-8-10)13(20,14(17,18)19)11-3-1-2-4-12(11)16/h1-8,20H |
InChIKey |
LUXSISXJGNCOKN-UHFFFAOYSA-N |
Molecular Weight |
370.490 g/mol |
SMILES |
C1=CC(C(C(Cl)(Cl)Cl)(C2=CC=CC=C2Cl)O)=CC=C1Cl |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.898132 |