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1,4-Dimethyl-7-methoxy-1,3,4,5-tetrahydro-2H-1,5-benzodiazepine-2-thione

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1,4-Dimethyl-7-methoxy-1,3,4,5-tetrahydro-2H-1,5-benzodiazepine-2-thione
SpectraBase Compound ID FNvlV3dgOHL
InChI InChI=1S/C12H16N2OS/c1-8-6-12(16)14(2)11-5-4-9(15-3)7-10(11)13-8/h4-5,7-8,13H,6H2,1-3H3
InChIKey PBCKRYDOTWAIPI-UHFFFAOYSA-N
Mol Weight 236.33 g/mol
Molecular Formula C12H16N2OS
Exact Mass 236.098334 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LFyDSGetlQT
Name 7-Methoxy-1,4-dimethyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepine-2-thione
CAS Registry Number 123229-14-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H16N2OS
InChI InChI=1S/C12H16N2OS/c1-8-6-12(16)14(2)11-5-4-9(15-3)7-10(11)13-8/h4-5,7-8,13H,6H2,1-3H3
InChIKey PBCKRYDOTWAIPI-UHFFFAOYSA-N
Instrument Name Bruker AM-400
Literature Reference F. Malik, M. Hassan, D. Rosenbaum, H. Duddeck, Magn. Res. Chem. 27, 391 (1989).
NMR Standard CDCl3
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3