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(Z)-and (E)-6-Methyl-1-phenyl-3,5,6-tris(phenylthio)hept-3-ene
SpectraBase Compound ID 36X3S71FGXq
InChI InChI=1S/C32H32S3/c1-32(2,35-29-21-13-6-14-22-29)31(34-28-19-11-5-12-20-28)25-30(33-27-17-9-4-10-18-27)24-23-26-15-7-3-8-16-26/h3-22,25,31H,23-24H2,1-2H3/b30-25-
InChIKey CUTKPHKVCOHFHJ-JVCXMKTPSA-N
Mol Weight 512.8 g/mol
Molecular Formula C32H32S3
Exact Mass 512.166615 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K3nqALZhZBL
Name (Z)-and (E)-6-Methyl-1-phenyl-3,5,6-tris(phenylthio)hept-3-ene
Alternate Name(s) {[(3Z)-1,1-dimethyl-6-phenyl-2,4-bis(phenylsulfanyl)-3-hexenyl]sulfanyl}benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H32S3
InChI InChI=1S/C32H32S3/c1-32(2,35-29-21-13-6-14-22-29)31(34-28-19-11-5-12-20-28)25-30(33-27-17-9-4-10-18-27)24-23-26-15-7-3-8-16-26/h3-22,25,31H,23-24H2,1-2H3/b30-25-
InChIKey CUTKPHKVCOHFHJ-JVCXMKTPSA-N
Molecular Weight 512.788 g/mol
SMILES C(\C=C\(Sc1ccccc1)CCc1ccccc1)(C(Sc1ccccc1)(C)C)Sc1ccccc1
SPLASH splash10-0f6x-8090400000-e0ce91b81979e9e67972
Source of Spectrum KC-0-2962-19
Wiley ID 782376