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6-(1-AMINOTHIOUREIDO)-5-METHOXY-1-METHYL-3-PHENYL-1,4-DIHYDRO-1,2,4-TRIAZINE

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6-(1-AMINOTHIOUREIDO)-5-METHOXY-1-METHYL-3-PHENYL-1,4-DIHYDRO-1,2,4-TRIAZINE
SpectraBase Compound ID DhMezrLnsSo
InChI InChI=1S/C12H16N6OS.BF4/c1-17-11(18(14)12(13)20)10(19-2)15-9(16-17)8-6-4-3-5-7-8;2-1(3,4)5/h3-7H,14H2,1-2H3,(H2,13,20)(H,15,16);/q;-1/p+1
InChIKey VEFFNUBRMCOXDW-UHFFFAOYSA-O
Mol Weight 380.2 g/mol
Molecular Formula C12H17BF4N6OS
Exact Mass 380.121373 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EcxgnGFwAlx
Name 6-(1-AMINOTHIOUREIDO)-5-METHOXY-1-METHYL-3-PHENYL-1,4-DIHYDRO-1,2,4-TRIAZINE
Compound Number 7XHBF4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H17BF4N6OS
InChI InChI=1S/C12H16N6OS.BF4/c1-17-11(18(14)12(13)20)10(19-2)15-9(16-17)8-6-4-3-5-7-8;2-1(3,4)5/h3-7H,14H2,1-2H3,(H2,13,20)(H,15,16);/q;-1/p+1
InChIKey VEFFNUBRMCOXDW-UHFFFAOYSA-O
Literature Reference Author O.N.CHUPAKHIN,G.L.RUSINOV,D.G.BERESNEV,V.N.CHARUSHIN,H.NEUNH OEFFER
Literature Reference Citation J.HETCYCL.CHEM.,38,901(2001)
Literature Reference DOI 10.1002/jhet.5570380414
Molecular Weight 380.170 g/mol
Solvent DMSO-D6
Source File Reference UWLU21370