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(3AR,7AS)-DIMETHYLHEXAHYDRO-IMIDAZO-[4,5-B]-PYRAZINE-2-THIONE
SpectraBase Compound ID BivGUvnIxru
InChI InChI=1S/C7H14N4S/c1-6-7(2,9-4-3-8-6)11-5(12)10-6/h8-9H,3-4H2,1-2H3,(H2,10,11,12)/t6-,7+
InChIKey KDDHWDWJQGUIFR-KNVOCYPGSA-N
Mol Weight 186.28 g/mol
Molecular Formula C7H14N4S
Exact Mass 186.093918 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DCfWILEVjwg
Name (3AR,7AS)-DIMETHYLHEXAHYDRO-IMIDAZO-[4,5-B]-PYRAZINE-2-THIONE
Compound Number 3A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H14N4S
InChI InChI=1S/C7H14N4S/c1-6-7(2,9-4-3-8-6)11-5(12)10-6/h8-9H,3-4H2,1-2H3,(H2,10,11,12)/t6-,7+
InChIKey KDDHWDWJQGUIFR-KNVOCYPGSA-N
Literature Reference Author K.NAKAHARA,S.TAKECHI,K.YAMAGUCHI,K.HARANO,T.YAMAGUCHI
Literature Reference Citation CHEM.PHARM.BULL.,57,1371(2009)
Literature Reference DOI 10.1248/cpb.57.1371
Molecular Weight 186.275 g/mol
Sample ID 3174
Solvent DMSO-D6