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1-Methyl-4-[(4-propylphenyl)ethynyl]benzene
SpectraBase Compound ID 9SqSNDDQxAS
InChI InChI=1S/C18H18/c1-3-4-16-9-11-18(12-10-16)14-13-17-7-5-15(2)6-8-17/h5-12H,3-4H2,1-2H3
InChIKey JTSDIGCQDCHIKJ-UHFFFAOYSA-N
Mol Weight 234.34 g/mol
Molecular Formula C18H18
Exact Mass 234.140851 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GzPgh8KQkWh
Name 1-Methyl-4-[(4-propylphenyl)ethynyl]benzene
Alternate Name(s) 1-Methyl-4-[2-(4-propylphenyl)ethynyl]benzene Benzene, 1-methyl-4-[(4-propylphenyl)ethynyl]-
CAS Registry Number 184161-94-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18
InChI InChI=1S/C18H18/c1-3-4-16-9-11-18(12-10-16)14-13-17-7-5-15(2)6-8-17/h5-12H,3-4H2,1-2H3
InChIKey JTSDIGCQDCHIKJ-UHFFFAOYSA-N
Molecular Weight 234.342 g/mol
SMILES Cc1ccc(C#Cc2ccc(cc2)CCC)cc1
SPLASH splash10-0a4i-1390000000-898950270fbc46a6251f
Wiley ID 1475836