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ANHYDRO-3-MERCAPTO-1,4-DIMETHYL-5-(3',5'-DIAMINO-6'-CHLORO-2'-PYRAZINYL)-1,2,4-TRIAZOLIUM-HYDROXIDE

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ANHYDRO-3-MERCAPTO-1,4-DIMETHYL-5-(3',5'-DIAMINO-6'-CHLORO-2'-PYRAZINYL)-1,2,4-TRIAZOLIUM-HYDROXIDE
SpectraBase Compound ID HwH2Mc7wpws
InChI InChI=1S/C8H10ClN7S/c1-15-7(16(2)14-8(15)17)3-5(10)13-6(11)4(9)12-3/h1-2H3,(H4,10,11,13,14,17)
InChIKey RBCHEJCDKJGROX-UHFFFAOYSA-N
Mol Weight 271.73 g/mol
Molecular Formula C8H10ClN7S
Exact Mass 271.040692 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9NSpumYOpYk
Name ANHYDRO-3-MERCAPTO-1,4-DIMETHYL-5-(3',5'-DIAMINO-6'-CHLORO-2'-PYRAZINYL)-1,2,4-TRIAZOLIUM-HYDROXIDE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H10ClN7S
InChI InChI=1S/C8H10ClN7S/c1-15-7(16(2)14-8(15)17)3-5(10)13-6(11)4(9)12-3/h1-2H3,(H4,10,11,13,14,17)
InChIKey RBCHEJCDKJGROX-UHFFFAOYSA-N
Literature Reference Author G.M.SHUTSKE,M.N.AGNEW
Literature Reference Citation J.HETCYCL.CHEM.,18,1025(1981)
Literature Reference DOI 10.1002/jhet.5570180534
Molecular Weight 271.727 g/mol
Solvent DMSO-D6
Source File Reference UWED7477