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2,6-Di-tert-butyl-4-(3-(p-tolyl) prop-2-yn-1-ylidene) cyclohexa-2,5-dien-1-one
SpectraBase Compound ID DAH7hUG6rjT
InChI InChI=1S/C24H28O/c1-17-11-13-18(14-12-17)9-8-10-19-15-20(23(2,3)4)22(25)21(16-19)24(5,6)7/h10-16H,1-7H3
InChIKey GKPIIRSJVFJAAG-UHFFFAOYSA-N
Mol Weight 332.49 g/mol
Molecular Formula C24H28O
Exact Mass 332.214016 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 78OQXTyz04M
Name 2,6-Di-tert-butyl-4-(3-(p-tolyl) prop-2-yn-1-ylidene) cyclohexa-2,5-dien-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H28O
InChI InChI=1S/C24H28O/c1-17-11-13-18(14-12-17)9-8-10-19-15-20(23(2,3)4)22(25)21(16-19)24(5,6)7/h10-16H,1-7H3
InChIKey GKPIIRSJVFJAAG-UHFFFAOYSA-N
Instrument Name GCMS-QP2010 SE
Ionization Type EI
Literature Reference DOI 10.1021/acs.orglett.1c02003
Molecular Weight 332.487 g/mol
SMILES C(C1=CC(C=C(C1=O)C(C)(C)C)=CC#Cc1ccc(cc1)C)(C)(C)C
SPLASH splash10-00or-0197000000-ceb20c140f2bf5116b7e
Source of Spectrum A1-23-SM3-1m
Wiley ID 1868093