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

*Links on SpectraBase are not permalinks.
3-Methyl-4-(2-Propynylthio)-2-vinyl-2-cyclohexene-1-one Trimethylene Dithioketal
SpectraBase Compound ID B3Pfc0BCEy
InChI InChI=1S/C15H20S3/c1-4-9-16-14-7-8-15(13(5-2)12(14)3)17-10-6-11-18-15/h1,5,14H,2,6-11H2,3H3
InChIKey SJJXBXYSRHVTKY-UHFFFAOYSA-N
Mol Weight 296.51 g/mol
Molecular Formula C15H20S3
Exact Mass 296.072714 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 HJET09Epe9E
Name 3-Methyl-4-(2-Propynylthio)-2-vinyl-2-cyclohexene-1-one Trimethylene Dithioketal
Alternate Name(s) 4-methyl-3-(propargylthio)-5-vinyl-7,11-dithiaspiro[5.5]undec-4-ene 4-methyl-3-prop-2-ynylsulfanyl-5-vinyl-7,11-dithiaspiro[5.5]undec-4-ene 5-ethenyl-4-methyl-3-(prop-2-ynylthio)-7,11-dithiaspiro[5.5]undec-4-ene 5-ethenyl-4-methyl-3-prop-2-ynylsulfanyl-7,11-dithiaspiro[5.5]undec-4-ene 8-methyl-7-vinyl-1,5-dithiaspiro[5.5]undec-7-en-9-yl 2-propynyl sulfide 8-methyl-9-(2-propynylsulfanyl)-7-vinyl-1,5-dithiaspiro[5.5]undec-7-ene 11-ethenyl-10-methyl-9-(prop-2-ynylthio)-1,5-dithiaspiro[5.5]undec-10-ene 10-methyl-9-prop-2-ynylsulfanyl-11-vinyl-1,5-dithiaspiro[5.5]undec-10-ene 11-ethenyl-10-methyl-9-prop-2-ynylsulfanyl-1,5-dithiaspiro[5.5]undec-10-ene
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H20S3
InChI InChI=1S/C15H20S3/c1-4-9-16-14-7-8-15(13(5-2)12(14)3)17-10-6-11-18-15/h1,5,14H,2,6-11H2,3H3
InChIKey SJJXBXYSRHVTKY-UHFFFAOYSA-N
Molecular Weight 296.505 g/mol
SMILES C=1(C2(SCCCS2)CCC(C1C)SCC#C)C=C
SPLASH splash10-004i-0090000000-8162b80aa8bb299d664e
Source of Spectrum J-59-1630-21
Wiley ID 1298883