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4-Chlorophenethyl alcohol, 2-methylbutyl ether

View entire compound with spectra: 1 NMR, and 1 FTIR

4-Chlorophenethyl alcohol, 2-methylbutyl ether
SpectraBase Compound ID J1UePkucXvg
InChI InChI=1S/C13H19ClO/c1-3-11(2)10-15-9-8-12-4-6-13(14)7-5-12/h4-7,11H,3,8-10H2,1-2H3
InChIKey GCOAYCGTXIZUDB-UHFFFAOYSA-N
Mol Weight 226.75 g/mol
Molecular Formula C13H19ClO
Exact Mass 226.112443 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID EUQUZeCN9re
Name 4-Chlorophenethyl alcohol, 2-methylbutyl ether
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 226.112442931 u
Formula C13H19ClO
InChI InChI=1S/C13H19ClO/c1-3-11(2)10-15-9-8-12-4-6-13(14)7-5-12/h4-7,11H,3,8-10H2,1-2H3
InChIKey GCOAYCGTXIZUDB-UHFFFAOYSA-N
Molecular Weight 226.747 g/mol
SMILES C1=CC(=CC=C1CCOCC(CC)C)Cl
Spectrum/Structure Validation Score (Vapor Phase IR) 0.889911