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[3-(4,4-dimethyl-1-cyclohex-2-enylidene)-5-phenylpenta-1,4-diynyl]benzene
SpectraBase Compound ID pnB0izDAQ2
InChI InChI=1S/C25H22/c1-25(2)19-17-24(18-20-25)23(15-13-21-9-5-3-6-10-21)16-14-22-11-7-4-8-12-22/h3-12,17,19H,18,20H2,1-2H3
InChIKey ICTSZIOYTFWQTQ-UHFFFAOYSA-N
Mol Weight 322.45 g/mol
Molecular Formula C25H22
Exact Mass 322.172151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4rwQ3l4Ulis
Name [3-(4,4-dimethyl-1-cyclohex-2-enylidene)-5-phenylpenta-1,4-diynyl]benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H22
InChI InChI=1S/C25H22/c1-25(2)19-17-24(18-20-25)23(15-13-21-9-5-3-6-10-21)16-14-22-11-7-4-8-12-22/h3-12,17,19H,18,20H2,1-2H3
InChIKey ICTSZIOYTFWQTQ-UHFFFAOYSA-N
Molecular Weight 322.451 g/mol
SMILES C(C(C#Cc1ccccc1)=C1C=CC(CC1)(C)C)#Cc1ccccc1
SPLASH splash10-00di-0029000000-430e842afc248a2b40d2
Source of Spectrum U1-2002-1715-24
Synonyms [3-(4,4-dimethylcyclohex-2-en-1-ylidene)-5-phenyl-penta-1,4-diynyl]benzene
Wiley ID 1522451