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(E,E)-12-Bromododeca-1,4,9-trien-3-one

View entire compound with spectra: 1 MS (GC)

(E,E)-12-Bromododeca-1,4,9-trien-3-one
SpectraBase Compound ID Kq0bYRD7OCG
InChI InChI=1S/C12H17BrO/c1-2-12(14)10-8-6-4-3-5-7-9-11-13/h2,5,7-8,10H,1,3-4,6,9,11H2/b7-5+,10-8+
InChIKey BVDXNUFGEKVZEL-RMTFUQJTSA-N
Mol Weight 257.17 g/mol
Molecular Formula C12H17BrO
Exact Mass 256.046278 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JmBeTcFTV8l
Name (E,E)-12-Bromododeca-1,4,9-trien-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H17BrO
InChI InChI=1S/C12H17BrO/c1-2-12(14)10-8-6-4-3-5-7-9-11-13/h2,5,7-8,10H,1,3-4,6,9,11H2/b7-5+,10-8+
InChIKey BVDXNUFGEKVZEL-RMTFUQJTSA-N
Molecular Weight 257.171 g/mol
SMILES C=CC(\C=C\CCC\C=C\CCBr)=O
SPLASH splash10-0a4i-9200000000-40d87334cc4a9be630e9
Source of Spectrum KC-0-26-30
Synonyms (4E,9E)-12-bromo-1,4,9-dodecatrien-3-one (4E,9E)-12-bromo-3-dodeca-1,4,9-trienone (4E,9E)-12-bromanyldodeca-1,4,9-trien-3-one
Wiley ID 784841