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4-Chlorophenethyl alcohol, 1-methylpropyl ether

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

4-Chlorophenethyl alcohol, 1-methylpropyl ether
SpectraBase Compound ID 1WRCfW4w8QX
InChI InChI=1S/C12H17ClO/c1-3-10(2)14-9-8-11-4-6-12(13)7-5-11/h4-7,10H,3,8-9H2,1-2H3
InChIKey NWJUQFBCNLYDJD-UHFFFAOYSA-N
Mol Weight 212.72 g/mol
Molecular Formula C12H17ClO
Exact Mass 212.096793 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID H8L6yi0aVzm
Name 4-Chlorophenethyl alcohol, 1-methylpropyl ether
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 212.096792866 u
Formula C12H17ClO
InChI InChI=1S/C12H17ClO/c1-3-10(2)14-9-8-11-4-6-12(13)7-5-11/h4-7,10H,3,8-9H2,1-2H3
InChIKey NWJUQFBCNLYDJD-UHFFFAOYSA-N
Molecular Weight 212.720 g/mol
SMILES C1=CC(=CC=C1CCOC(CC)C)Cl
Spectrum/Structure Validation Score (Vapor Phase IR) 0.953634