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(3aS,8S,8aR)-8-1-[Bis(methylthio)propen-2-yl]-5,6-(dimethoxy)cyclopenta[a]ind-2-ene
SpectraBase Compound ID HUgZ8VoYyPE
InChI InChI=1S/C19H24O2S2/c1-11(19(22-4)23-5)18-13-8-6-7-12(13)14-9-16(20-2)17(21-3)10-15(14)18/h6-7,9-10,12-13,18H,8H2,1-5H3/t12-,13+,18-/m0/s1
InChIKey HHWMHHJYTQRRAM-JCGVRSQUSA-N
Mol Weight 348.52 g/mol
Molecular Formula C19H24O2S2
Exact Mass 348.121772 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B0HFmm5wbIG
Name (3aS,8S,8aR)-8-1-[Bis(methylthio)propen-2-yl]-5,6-(dimethoxy)cyclopenta[a]ind-2-ene
Alternate Name(s) (3aS,8S,8aR)-5,6-dimethoxy-8-[1-methyl-2,2-bis(methylsulfanyl)vinyl]-1,3a,8,8a-tetrahydrocyclopenta[a]indene (3aS,R,8S,R,8aR,S)-8-[1-[Bis(methylthio)propen-2-yl]-5,6-(dimethoxy)cyclopenta[a]ind-2-ene
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H24O2S2
InChI InChI=1S/C19H24O2S2/c1-11(19(22-4)23-5)18-13-8-6-7-12(13)14-9-16(20-2)17(21-3)10-15(14)18/h6-7,9-10,12-13,18H,8H2,1-5H3/t12-,13+,18-/m0/s1
InChIKey HHWMHHJYTQRRAM-JCGVRSQUSA-N
Molecular Weight 348.519 g/mol
SMILES c12[C@]([C@@]3(CC=C[C@@]3(c2cc(c(c1)OC)OC)[H])[H])(C(=C(SC)SC)C)[H]
SPLASH splash10-0udj-0097000000-e617cf985f8d8e0518db
Source of Spectrum F-54-538-21
Wiley ID 805357