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(1S,2S,4R,8S)-2-[bis(methylsulfanyl)methyl]-2,4-dimethoxy-3-oxidanylidene-bicyclo[2.2.2]oct-5-ene-8-carbaldehyde
SpectraBase Compound ID GOED1W8BMj6
InChI InChI=1S/C14H20O4S2/c1-17-13-6-5-9(7-10(13)8-15)14(18-2,11(13)16)12(19-3)20-4/h5-6,8-10,12H,7H2,1-4H3/t9-,10-,13-,14+/m1/s1
InChIKey HVYVNKQIPVUMIP-MHWZDGSBSA-N
Mol Weight 316.43 g/mol
Molecular Formula C14H20O4S2
Exact Mass 316.080301 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I54UtFmX0IB
Name (1S,2S,4R,8S)-2-[bis(methylsulfanyl)methyl]-2,4-dimethoxy-3-oxidanylidene-bicyclo[2.2.2]oct-5-ene-8-carbaldehyde
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20O4S2
InChI InChI=1S/C14H20O4S2/c1-17-13-6-5-9(7-10(13)8-15)14(18-2,11(13)16)12(19-3)20-4/h5-6,8-10,12H,7H2,1-4H3/t9-,10-,13-,14+/m1/s1
InChIKey HVYVNKQIPVUMIP-MHWZDGSBSA-N
Molecular Weight 316.430 g/mol
SMILES C1([C@@]([C@@]2([H])C[C@@]([C@@]1(C=C2)OC)(C=O)[H])(C(SC)SC)OC)=O
SPLASH splash10-0a4i-0911000000-bf21d5a78c769f3f3019
Source of Spectrum KC-0-570-21
Synonyms (1S,2S,4R,8S)-2-[bis(methylsulfanyl)methyl]-2,4-dimethoxy-3-oxo-bicyclo[2.2.2]oct-5-ene-8-carbaldehyde (1S,2S,4R,8S)-2-[bis(methylthio)methyl]-2,4-dimethoxy-3-oxo-8-bicyclo[2.2.2]oct-5-enecarboxaldehyde (1S,2S,4R,8S)-2-[bis(methylthio)methyl]-3-keto-2,4-dimethoxy-bicyclo[2.2.2]oct-5-ene-8-carbaldehyde
Wiley ID 787483