SpectraBase Spectrum ID |
HgLYuGPjzrd |
Name |
2,6-Dichlorobenzyl ether |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
333.948575741 u |
Formula |
C14H10Cl4O |
InChI |
InChI=1S/C14H10Cl4O/c15-11-3-1-9(13(17)5-11)7-19-8-10-2-4-12(16)6-14(10)18/h1-6H,7-8H2 |
InChIKey |
NWYHVMDKERUNLM-UHFFFAOYSA-N |
Molecular Weight |
336.045 g/mol |
SMILES |
C1(=CC=C(C=C1Cl)Cl)COCC1=C(C=C(C=C1)Cl)Cl |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.939231 |