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[(3E)-3-bromanyl-3-(4,4-dimethylcyclohex-2-en-1-ylidene)prop-1-ynyl]benzene
SpectraBase Compound ID Agx7XgJHQpv
InChI InChI=1S/C17H17Br/c1-17(2)12-10-15(11-13-17)16(18)9-8-14-6-4-3-5-7-14/h3-7,10,12H,11,13H2,1-2H3/b16-15-
InChIKey UOYIZLTVGLXQPR-NXVVXOECSA-N
Mol Weight 301.23 g/mol
Molecular Formula C17H17Br
Exact Mass 300.051364 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1vRHVtOpvWZ
Name [(3E)-3-bromanyl-3-(4,4-dimethylcyclohex-2-en-1-ylidene)prop-1-ynyl]benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17Br
InChI InChI=1S/C17H17Br/c1-17(2)12-10-15(11-13-17)16(18)9-8-14-6-4-3-5-7-14/h3-7,10,12H,11,13H2,1-2H3/b16-15-
InChIKey UOYIZLTVGLXQPR-NXVVXOECSA-N
Molecular Weight 301.227 g/mol
SMILES C1=C\C(CCC1(C)C)=C/(C#Cc1ccccc1)Br
SPLASH splash10-0uy3-2945000000-cd52486db0b45277f83e
Source of Spectrum U1-2002-1715-26
Synonyms [(3E)-3-bromo-3-(4,4-dimethyl-1-cyclohex-2-enylidene)prop-1-ynyl]benzene [(3E)-3-bromo-3-(4,4-dimethylcyclohex-2-en-1-ylidene)prop-1-ynyl]benzene
Wiley ID 1522580