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2-(2-Chlorophenoxy)ethanol, N-pentyl ether

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

2-(2-Chlorophenoxy)ethanol, N-pentyl ether
SpectraBase Compound ID IfibYg4z6mn
InChI InChI=1S/C13H19ClO2/c1-2-3-6-9-15-10-11-16-13-8-5-4-7-12(13)14/h4-5,7-8H,2-3,6,9-11H2,1H3
InChIKey STZNZUSGVIBNSY-UHFFFAOYSA-N
Mol Weight 242.75 g/mol
Molecular Formula C13H19ClO2
Exact Mass 242.107358 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 6ew3ul2ucCD
Name 2-(2-Chlorophenoxy)ethanol, N-pentyl ether
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 242.107357550 u
Formula C13H19ClO2
InChI InChI=1S/C13H19ClO2/c1-2-3-6-9-15-10-11-16-13-8-5-4-7-12(13)14/h4-5,7-8H,2-3,6,9-11H2,1H3
InChIKey STZNZUSGVIBNSY-UHFFFAOYSA-N
Molecular Weight 242.746 g/mol
SMILES C1(=CC=CC=C1OCCOCCCCC)Cl
Spectrum/Structure Validation Score (Vapor Phase IR) 0.924298