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(5-(2-Chloroethoxy)-5-ethoxypent-3-yn-1-yl)benzene

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

(5-(2-Chloroethoxy)-5-ethoxypent-3-yn-1-yl)benzene
SpectraBase Compound ID 9HjmWiZ73PB
InChI InChI=1S/C15H19ClO2/c1-2-17-15(18-13-12-16)11-7-6-10-14-8-4-3-5-9-14/h3-5,8-9,15H,2,6,10,12-13H2,1H3
InChIKey JLGSWZRZXPUKEL-UHFFFAOYSA-N
Mol Weight 266.77 g/mol
Molecular Formula C15H19ClO2
Exact Mass 266.107358 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID HjFNmvsfzFD
Name (5-(2-Chloroethoxy)-5-ethoxypent-3-yn-1-yl)benzene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 266.107357550 u
Formula C15H19ClO2
InChI InChI=1S/C15H19ClO2/c1-2-17-15(18-13-12-16)11-7-6-10-14-8-4-3-5-9-14/h3-5,8-9,15H,2,6,10,12-13H2,1H3
InChIKey JLGSWZRZXPUKEL-UHFFFAOYSA-N
Molecular Weight 266.768 g/mol
SMILES C(C(OCC)OCCCl)#CCCC1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.944575