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2-Methoxy-1-(4-methylsulfanyl-2H-1,5-benzothiazepin-5-yl)ethanone
SpectraBase Compound ID 58gK1SRk5PA
InChI InChI=1S/C13H15NO2S2/c1-16-9-12(15)14-10-5-3-4-6-11(10)18-8-7-13(14)17-2/h3-7H,8-9H2,1-2H3
InChIKey DHJYZWSMFWIVQY-UHFFFAOYSA-N
Mol Weight 281.39 g/mol
Molecular Formula C13H15NO2S2
Exact Mass 281.054421 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3KiT6GRWsSc
Name 2-Methoxy-1-(4-methylsulfanyl-2H-1,5-benzothiazepin-5-yl)ethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15NO2S2
InChI InChI=1S/C13H15NO2S2/c1-16-9-12(15)14-10-5-3-4-6-11(10)18-8-7-13(14)17-2/h3-7H,8-9H2,1-2H3
InChIKey DHJYZWSMFWIVQY-UHFFFAOYSA-N
Molecular Weight 281.388 g/mol
SMILES C=1(N(c2c(SCC1)cccc2)C(=O)COC)SC
SPLASH splash10-001i-0290000000-9663df3113cc0e2776d2
Source of Spectrum Y-34-826-32
Synonyms 2-Methoxy-1-[4-(methylthio)-2H-1,5-benzothiazepin-5-yl]ethanone
Wiley ID 1284703