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(E)-7-bromo-3-(phenylthio)-1,3-heptadiene
SpectraBase Compound ID 9vgbcmgiTMN
InChI InChI=1S/C13H15BrS/c1-2-12(8-6-7-11-14)15-13-9-4-3-5-10-13/h2-5,8-10H,1,6-7,11H2/b12-8+
InChIKey UJGSQMSSTDOKAT-XYOKQWHBSA-N
Mol Weight 283.23 g/mol
Molecular Formula C13H15BrS
Exact Mass 282.007785 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AQBIu6Wynsd
Name (E)-7-bromo-3-(phenylthio)-1,3-heptadiene
CAS Registry Number 123289-42-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15BrS
InChI InChI=1S/C13H15BrS/c1-2-12(8-6-7-11-14)15-13-9-4-3-5-10-13/h2-5,8-10H,1,6-7,11H2/b12-8+
InChIKey UJGSQMSSTDOKAT-XYOKQWHBSA-N
Molecular Weight 283.227 g/mol
SMILES c1(S\C(C=C)=C/CCCBr)ccccc1
SPLASH splash10-01u3-9870000000-bccb331e96455ef05f1f
Source of Spectrum J-54-5818-7
Synonyms (1E)-5-bromo-1-vinyl-1-pentenyl phenyl sulfide {[(1E)-5-bromo-1-vinyl-1-pentenyl]sulfanyl}benzene
Wiley ID 1285484