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1-(ethylthio)-5-(exo-2-methoxyvinyliden)-6,6-dimethyl-4-phenyl-2,7-dithiabicyclo[2.2.1]heptan-3-one
SpectraBase Compound ID AdJlTpme7j1
InChI InChI=1S/C18H20O2S3/c1-5-21-18-16(2,3)14(11-12-20-4)17(23-18,15(19)22-18)13-9-7-6-8-10-13/h6-10,12H,5H2,1-4H3
InChIKey CMDCDBDMUSNGPW-UHFFFAOYSA-N
Mol Weight 364.54 g/mol
Molecular Formula C18H20O2S3
Exact Mass 364.062543 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4Iqd6AGBiX9
Name 1-(ethylthio)-5-(exo-2-methoxyvinyliden)-6,6-dimethyl-4-phenyl-2,7-dithiabicyclo[2.2.1]heptan-3-one
CAS Registry Number 100094-85-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20O2S3
InChI InChI=1S/C18H20O2S3/c1-5-21-18-16(2,3)14(11-12-20-4)17(23-18,15(19)22-18)13-9-7-6-8-10-13/h6-10,12H,5H2,1-4H3
InChIKey CMDCDBDMUSNGPW-UHFFFAOYSA-N
Molecular Weight 364.536 g/mol
SMILES C12(SC(=O)C(S2)(c2ccccc2)C(C1(C)C)=C=COC)SCC
SPLASH splash10-0gb9-0904000000-fde0696c19065efa680a
Source of Spectrum K-118-3458-5
Synonyms 1-(ethylsulfanyl)-5-(2-methoxyethenylidene)-6,6-dimethyl-4-phenyl-2,7-dithiabicyclo[2.2.1]heptan-3-one
Wiley ID 1350639