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6-Ethyl-2a-methylsulfanyl-2-phenoxy-2a,3-dihydro-2H-4,5-dithia-7b-aza-cyclobuta[e]inden-1-one
SpectraBase Compound ID INlybL24rXr
InChI InChI=1S/C17H17NO2S3/c1-3-12-9-13-16(23-12)22-10-17(21-2)14(15(19)18(13)17)20-11-7-5-4-6-8-11/h4-9,14H,3,10H2,1-2H3
InChIKey BUPHBTJGOYSUIT-UHFFFAOYSA-N
Mol Weight 363.51 g/mol
Molecular Formula C17H17NO2S3
Exact Mass 363.042142 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I4WWn8uYCyL
Name 6-Ethyl-2a-methylsulfanyl-2-phenoxy-2a,3-dihydro-2H-4,5-dithia-7b-aza-cyclobuta[e]inden-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17NO2S3
InChI InChI=1S/C17H17NO2S3/c1-3-12-9-13-16(23-12)22-10-17(21-2)14(15(19)18(13)17)20-11-7-5-4-6-8-11/h4-9,14H,3,10H2,1-2H3
InChIKey BUPHBTJGOYSUIT-UHFFFAOYSA-N
Molecular Weight 363.508 g/mol
SMILES C12(N(c3c(SC2)sc(c3)CC)C(C1Oc1ccccc1)=O)SC
SPLASH splash10-00di-0090000000-7d53ef7e639805768190
Source of Spectrum H1-38-1633-10
Synonyms 2-Ethyl-5a,6-dihydroxy-5a-methylthio-6-phenoxyazeto[1,2-d]thieno[2,3-b][1,4]thiazin-7(5H)-one 2-Ethyl-5a-(methylsulfanyl)-6-phenoxy-5a,6-dihydroazeto[1,2-d]thieno[2,3-b][1,4]thiazin-7(5H)-one 2-Ethyl-5a-methylthio-6-phenoxyazeto[1,2-d]thieno[2,3-b][1,4]thiazin-7(5H)-one
Wiley ID 756562