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3-[(N,N-DIMETHYLAMINO)-METHYLIDENE]-AMINO-6-METHYL-1,2,4-TRIAZIN-5-(2H)-ONE
SpectraBase Compound ID DpugqcQ5kuJ
InChI InChI=1S/C7H11N5O/c1-5-6(13)9-7(11-10-5)8-4-12(2)3/h4H,1-3H3,(H,9,11,13)/b8-4+
InChIKey VDNHGYFKHVBWOS-XBXARRHUSA-N
Mol Weight 181.2 g/mol
Molecular Formula C7H11N5O
Exact Mass 181.09636 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5qpwJBZFCEe
Name 3-[(N,N-DIMETHYLAMINO)-METHYLIDENE]-AMINO-6-METHYL-1,2,4-TRIAZIN-5-(2H)-ONE
Compound Number 13A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H11N5O
InChI InChI=1S/C7H11N5O/c1-5-6(13)9-7(11-10-5)8-4-12(2)3/h4H,1-3H3,(H,9,11,13)/b8-4+
InChIKey VDNHGYFKHVBWOS-XBXARRHUSA-N
Literature Reference Author F.SEELA,Y.HE
Literature Reference Citation J.ORG.CHEM.,68,367(2003)
Literature Reference DOI 10.1021/jo020507n
Molecular Weight 181.197 g/mol
Solvent DMSO-D6
Source File Reference UWVN25010