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(1E,4Z)-1-Phenyl-5-(phenylthio)-1,4-nonadiene
SpectraBase Compound ID CGG4fByLILU
InChI InChI=1S/C21H24S/c1-2-3-15-20(22-21-16-8-5-9-17-21)18-11-10-14-19-12-6-4-7-13-19/h4-10,12-14,16-18H,2-3,11,15H2,1H3/b14-10+,20-18-
InChIKey JXQJMAOYEYWXEM-SQTQCTRYSA-N
Mol Weight 308.48 g/mol
Molecular Formula C21H24S
Exact Mass 308.159872 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AJk5mAGCdjK
Name (1E,4Z)-1-Phenyl-5-(phenylthio)-1,4-nonadiene
Alternate Name(s) (1Z,4E)-1-butyl-5-phenyl-1,4-pentadienyl phenyl sulfide {[(1Z,4E)-1-butyl-5-phenyl-1,4-pentadienyl]sulfanyl}benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H24S
InChI InChI=1S/C21H24S/c1-2-3-15-20(22-21-16-8-5-9-17-21)18-11-10-14-19-12-6-4-7-13-19/h4-10,12-14,16-18H,2-3,11,15H2,1H3/b14-10+,20-18-
InChIKey JXQJMAOYEYWXEM-SQTQCTRYSA-N
Molecular Weight 308.483 g/mol
SMILES C(\C=C\(Sc1ccccc1)CCCC)\C=C\c1ccccc1
SPLASH splash10-0006-7904000000-a0e60f6e58c798a7e9b2
Source of Spectrum C-115-7225-0
Wiley ID 1310336