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Benzene, 1-methoxy-2-[(4-methylphenyl)ethynyl]-
SpectraBase Compound ID 5Z8J5plZCk8
InChI InChI=1S/C16H14O/c1-13-7-9-14(10-8-13)11-12-15-5-3-4-6-16(15)17-2/h3-10H,1-2H3
InChIKey KYRKZBFKNAAUBT-UHFFFAOYSA-N
Mol Weight 222.29 g/mol
Molecular Formula C16H14O
Exact Mass 222.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CaV6aQJfXCf
Name Benzene, 1-methoxy-2-[(4-methylphenyl)ethynyl]-
CAS Registry Number 122134-95-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14O
InChI InChI=1S/C16H14O/c1-13-7-9-14(10-8-13)11-12-15-5-3-4-6-16(15)17-2/h3-10H,1-2H3
InChIKey KYRKZBFKNAAUBT-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo101126q
Molecular Weight 222.287 g/mol
SMILES c1cc(C#Cc2ccc(cc2)C)c(OC)cc1
SPLASH splash10-00di-0590000000-e5e9233346c7eff32177
Source of Spectrum J-75-5701/SM3-1d
Synonyms 2-[(4-Methylphenyl)-ethynyl]anisole 1-Methoxy-2-[2-(4-methylphenyl)ethynyl]benzene 1-Methoxy-2-(p-tolylethynyl)benzene
Wiley ID 1751738