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trans-7,7-Bis(phenylthio)-2-heptene

View entire compound with spectra: 1 MS (GC)

trans-7,7-Bis(phenylthio)-2-heptene
SpectraBase Compound ID IIVPJvuEoON
InChI InChI=1S/C19H22S2/c1-2-3-4-11-16-19(20-17-12-7-5-8-13-17)21-18-14-9-6-10-15-18/h2-3,5-10,12-15,19H,4,11,16H2,1H3/b3-2+
InChIKey ORRKLVLPFUNWKC-NSCUHMNNSA-N
Mol Weight 314.51 g/mol
Molecular Formula C19H22S2
Exact Mass 314.116293 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dm5WRApl9U1
Name trans-7,7-Bis(phenylthio)-2-heptene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H22S2
InChI InChI=1S/C19H22S2/c1-2-3-4-11-16-19(20-17-12-7-5-8-13-17)21-18-14-9-6-10-15-18/h2-3,5-10,12-15,19H,4,11,16H2,1H3/b3-2+
InChIKey ORRKLVLPFUNWKC-NSCUHMNNSA-N
Molecular Weight 314.505 g/mol
SMILES C\C=C\CCCC(Sc1ccccc1)Sc1ccccc1
SPLASH splash10-0a4i-3930000000-52a2b5774892730197ee
Source of Spectrum F-53-4304-19
Synonyms {[(5E)-1-(phenylsulfanyl)-5-heptenyl]sulfanyl}benzene
Wiley ID 801240