For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(Z)-(4RS,5RS)-4,6-Dimethyl-3,5,6-tris(phenylthio)hept-2-ene
SpectraBase Compound ID 3L95q1DDgfy
InChI InChI=1S/C27H30S3/c1-5-25(28-22-15-9-6-10-16-22)21(2)26(29-23-17-11-7-12-18-23)27(3,4)30-24-19-13-8-14-20-24/h5-21,26H,1-4H3/b25-5-
InChIKey MBABLKQTJDRMJZ-FISMNSNESA-N
Mol Weight 450.72 g/mol
Molecular Formula C27H30S3
Exact Mass 450.150964 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID AK1sY45s1O
Name (Z)-(4RS,5RS)-4,6-Dimethyl-3,5,6-tris(phenylthio)hept-2-ene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H30S3
InChI InChI=1S/C27H30S3/c1-5-25(28-22-15-9-6-10-16-22)21(2)26(29-23-17-11-7-12-18-23)27(3,4)30-24-19-13-8-14-20-24/h5-21,26H,1-4H3/b25-5-
InChIKey MBABLKQTJDRMJZ-FISMNSNESA-N
Molecular Weight 450.717 g/mol
SMILES C(\C(Sc1ccccc1)=C\C)(C(C(Sc1ccccc1)(C)C)Sc1ccccc1)C
SPLASH splash10-006x-0924000000-b220f6c8ab30815a58eb
Source of Spectrum KC-0-2960-17
Synonyms {[(4Z)-1,1,3-trimethyl-2,4-bis(phenylsulfanyl)-4-hexenyl]sulfanyl}benzene
Wiley ID 782390