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[1-(4-Aminofurazan-3-yl)-5-methyl-1H-[1,2,3]triazol-4-yl](phenyl)methanone
SpectraBase Compound ID AtUgkM153YJ
InChI InChI=1S/C12H10N6O2/c1-7-9(10(19)8-5-3-2-4-6-8)14-17-18(7)12-11(13)15-20-16-12/h2-6H,1H3,(H2,13,15)
InChIKey ICROFYVSDAJZRI-UHFFFAOYSA-N
Mol Weight 270.25 g/mol
Molecular Formula C12H10N6O2
Exact Mass 270.086524 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7wkQxHYkCuH
Name [1-(4-Aminofurazan-3-yl)-5-methyl-1H-[1,2,3]triazol-4-yl](phenyl)methanone
Comments Computed using HOSE algorithm
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Exact Mass 270.086523584 u
Formula C12H10N6O2
InChI InChI=1S/C12H10N6O2/c1-7-9(10(19)8-5-3-2-4-6-8)14-17-18(7)12-11(13)15-20-16-12/h2-6H,1H3,(H2,13,15)
InChIKey ICROFYVSDAJZRI-UHFFFAOYSA-N
SMILES C1=CC=C(C=C1)C(C1=C(N(C=2C(=NON2)N)N=N1)C)=O