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(1S,2S,4R,8S)-2,4-dimethoxy-8-methyl-2-(methylsulfanylmethyl)-3-oxidanylidene-bicyclo[2.2.2]oct-5-ene-8-carbaldehyde
SpectraBase Compound ID CTWjovWNnr7
InChI InChI=1S/C14H20O4S/c1-12(8-15)7-10-5-6-14(12,18-3)11(16)13(10,17-2)9-19-4/h5-6,8,10H,7,9H2,1-4H3/t10-,12-,13+,14+/m1/s1
InChIKey OEWVGXASAFPPGW-ZZVYKPCYSA-N
Mol Weight 284.37 g/mol
Molecular Formula C14H20O4S
Exact Mass 284.10823 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AtcvZYGBmY2
Name (1S,2S,4R,8S)-2,4-dimethoxy-8-methyl-2-(methylsulfanylmethyl)-3-oxidanylidene-bicyclo[2.2.2]oct-5-ene-8-carbaldehyde
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20O4S
InChI InChI=1S/C14H20O4S/c1-12(8-15)7-10-5-6-14(12,18-3)11(16)13(10,17-2)9-19-4/h5-6,8,10H,7,9H2,1-4H3/t10-,12-,13+,14+/m1/s1
InChIKey OEWVGXASAFPPGW-ZZVYKPCYSA-N
Molecular Weight 284.370 g/mol
SMILES [C@]12(C([C@](OC)(CSC)[C@](C=C2)(C[C@@]1(C=O)C)[H])=O)OC
SPLASH splash10-0a4i-3090000000-ecc97cfe6d4e3e24d0a2
Source of Spectrum KC-0-568-8
Synonyms (1S,2S,4R,8S)-2,4-dimethoxy-8-methyl-2-(methylsulfanylmethyl)-3-oxo-bicyclo[2.2.2]oct-5-ene-8-carbaldehyde (1S,2S,4R,8S)-2,4-dimethoxy-8-methyl-2-[(methylthio)methyl]-3-oxo-8-bicyclo[2.2.2]oct-5-enecarboxaldehyde (1S,2S,4R,8S)-3-keto-2,4-dimethoxy-8-methyl-2-[(methylthio)methyl]bicyclo[2.2.2]oct-5-ene-8-carbaldehyde
Wiley ID 787504