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(1R,S,5S,R)-2-Bis(methylthio)-3-(4-methoxyphenyl)-1-methylbicyclo[3.3.0]oct-3-en-8-one
SpectraBase Compound ID Hk2BQaIT78I
InChI InChI=1S/C18H22O2S2/c1-17-13(7-10-16(17)19)11-15(18(17,21-3)22-4)12-5-8-14(20-2)9-6-12/h5-6,8-9,11,13H,7,10H2,1-4H3
InChIKey FSQDVXTWXRPYLV-UHFFFAOYSA-N
Mol Weight 334.49 g/mol
Molecular Formula C18H22O2S2
Exact Mass 334.106122 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HZ69kJnMorR
Name (1R,S,5S,R)-2-Bis(methylthio)-3-(4-methoxyphenyl)-1-methylbicyclo[3.3.0]oct-3-en-8-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H22O2S2
InChI InChI=1S/C18H22O2S2/c1-17-13(7-10-16(17)19)11-15(18(17,21-3)22-4)12-5-8-14(20-2)9-6-12/h5-6,8-9,11,13H,7,10H2,1-4H3
InChIKey FSQDVXTWXRPYLV-UHFFFAOYSA-N
Molecular Weight 334.492 g/mol
SMILES C1(C2(C(CCC2=O)C=C1c1ccc(cc1)OC)C)(SC)SC
SPLASH splash10-000i-0090000000-2b67d3224808d421159d
Source of Spectrum F-54-537-13
Synonyms 5-(4-Methoxyphenyl)-6a-methyl-6,6-bis(methylsulfanyl)-3,3a,6,6a-tetrahydro-1(2H)-pentalenone
Wiley ID 805360