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1-Bromo-7-phenylhepta-1,3,5-triene
SpectraBase Compound ID KR8SWbrUvrp
InChI InChI=1S/C13H13Br/c14-12-8-3-1-2-5-9-13-10-6-4-7-11-13/h1-8,10-12H,9H2/b3-1+,5-2+,12-8+
InChIKey OUJBJCWJLAEZJY-XZSWUTCOSA-N
Mol Weight 249.15 g/mol
Molecular Formula C13H13Br
Exact Mass 248.020063 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hu1Dvj5Oj87
Name 1-Bromo-7-phenylhepta-1,3,5-triene
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13Br
InChI InChI=1S/C13H13Br/c14-12-8-3-1-2-5-9-13-10-6-4-7-11-13/h1-8,10-12H,9H2/b3-1+,5-2+,12-8+
InChIKey OUJBJCWJLAEZJY-XZSWUTCOSA-N
Molecular Weight 249.151 g/mol
SMILES C(\C=C\C=C\C=C\Br)c1ccccc1
SPLASH splash10-0006-9010000000-5add1ec80a4b26d60786
Source of Spectrum K1-2001-568-1
Synonyms [(2E,4E,6E)-7-bromo-2,4,6-heptatrienyl]benzene
Wiley ID 846720