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5-keto-4-methyl-2-(methylthio)pyrido[3,2-f][1,4]thiazepine-3-carbonitrile
SpectraBase Compound ID AkxrmKxdffm
InChI InChI=1S/C11H9N3OS2/c1-14-8(6-12)11(16-2)17-9-7(10(14)15)4-3-5-13-9/h3-5H,1-2H3
InChIKey FXQFZYBRLBLXDT-UHFFFAOYSA-N
Mol Weight 263.33 g/mol
Molecular Formula C11H9N3OS2
Exact Mass 263.018704 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IQWi48vsijy
Name 5-keto-4-methyl-2-(methylthio)pyrido[3,2-f][1,4]thiazepine-3-carbonitrile
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H9N3OS2
InChI InChI=1S/C11H9N3OS2/c1-14-8(6-12)11(16-2)17-9-7(10(14)15)4-3-5-13-9/h3-5H,1-2H3
InChIKey FXQFZYBRLBLXDT-UHFFFAOYSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2010)
Molecular Weight 263.332 g/mol
Source File Reference MHKO26895