SpectraBase Spectrum ID |
Do5ck3IJ4TH |
Name |
2,4-Dichlorophenethyl alcohol, N-propyl ether |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
232.042170470 u |
Formula |
C11H14Cl2O |
InChI |
InChI=1S/C11H14Cl2O/c1-2-6-14-7-5-9-3-4-10(12)8-11(9)13/h3-4,8H,2,5-7H2,1H3 |
InChIKey |
NEOLRSCTKIXAJH-UHFFFAOYSA-N |
Molecular Weight |
233.138 g/mol |
SMILES |
C1(=C(C=C(C=C1)Cl)Cl)CCOCCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.842598 |