Benzene, 1-[(4-chlorophenyl)ethynyl]-2-methoxy-

SpectraBase Compound ID	HB0vUyFzJtr
InChI	InChI=1S/C15H11ClO/c1-17-15-5-3-2-4-13(15)9-6-12-7-10-14(16)11-8-12/h2-5,7-8,10-11H,1H3
InChIKey	MHNUWTKWSOTAIQ-UHFFFAOYSA-N Google Search
Mol Weight	242.7 g/mol
Molecular Formula	C15H11ClO
Exact Mass	242.049843 g/mol

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SpectraBase Spectrum ID	Hy6EeoLpx7m
Name	Benzene, 1-[(4-chlorophenyl)ethynyl]-2-methoxy-
Comments	Computed using SmartSpectra Model v1.42
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	242.049842673 u
Formula	C15H11ClO
InChI	InChI=1S/C15H11ClO/c1-17-15-5-3-2-4-13(15)9-6-12-7-10-14(16)11-8-12/h2-5,7-8,10-11H,1H3
InChIKey	MHNUWTKWSOTAIQ-UHFFFAOYSA-N
Molecular Weight	242.705 g/mol
SMILES	C(#CC1=CC=C(C=C1)Cl)C=1C(OC)=CC=CC1
Spectrum/Structure Validation Score (Vapor Phase IR)	0.907664