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[(3Z,5E)-3-bromanyl-8-phenyl-octa-3,5-dien-1-ynyl]benzene
SpectraBase Compound ID KN8uE5zdpgW
InChI InChI=1S/C20H17Br/c21-20(17-16-19-13-6-2-7-14-19)15-9-3-8-12-18-10-4-1-5-11-18/h1-7,9-11,13-15H,8,12H2/b9-3+,20-15-
InChIKey NXMREPXLSHQYTL-RFVIWUTBSA-N
Mol Weight 337.26 g/mol
Molecular Formula C20H17Br
Exact Mass 336.051364 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B0cxRgGbSym
Name [(3Z,5E)-3-bromanyl-8-phenyl-octa-3,5-dien-1-ynyl]benzene
Alternate Name(s) [(3Z,5E)-3-bromo-8-phenyl-octa-3,5-dien-1-ynyl]benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H17Br
InChI InChI=1S/C20H17Br/c21-20(17-16-19-13-6-2-7-14-19)15-9-3-8-12-18-10-4-1-5-11-18/h1-7,9-11,13-15H,8,12H2/b9-3+,20-15-
InChIKey NXMREPXLSHQYTL-RFVIWUTBSA-N
Molecular Weight 337.260 g/mol
SMILES C(#Cc1ccccc1)\C(=C\C=C\CCc1ccccc1)Br
SPLASH splash10-014s-0975000000-fdca3202abc152a7d525
Source of Spectrum J-63-8974-12
Wiley ID 1332486