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1-Methyl-2-[(Z)-4-(2-methylphenyl)but-1-en-3-ynyl]benzene
SpectraBase Compound ID H8yLoULB7DX
InChI InChI=1S/C18H16/c1-15-9-3-5-11-17(15)13-7-8-14-18-12-6-4-10-16(18)2/h3-7,9-13H,1-2H3/b13-7-
InChIKey SQWUSYGUMIFEIJ-QPEQYQDCSA-N
Mol Weight 232.33 g/mol
Molecular Formula C18H16
Exact Mass 232.125201 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CNYYgqU0h6N
Name 1-Methyl-2-[(Z)-4-(2-methylphenyl)but-1-en-3-ynyl]benzene
Alternate Name(s) 1-Methyl-2-[(Z)-4-(o-tolyl)but-1-en-3-ynyl]benzene
CAS Registry Number 259090-89-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H16
InChI InChI=1S/C18H16/c1-15-9-3-5-11-17(15)13-7-8-14-18-12-6-4-10-16(18)2/h3-7,9-13H,1-2H3/b13-7-
InChIKey SQWUSYGUMIFEIJ-QPEQYQDCSA-N
Molecular Weight 232.326 g/mol
SMILES C(\C=C/c1c(cccc1)C)#Cc1c(cccc1)C
SPLASH splash10-0159-0290000000-19a88f5d4dd75de87e37
Source of Spectrum F-70-7264-3
Wiley ID 1597424