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N-(2-methyl-2H-tetraazol-5-yl)-1-naphthamide
SpectraBase Compound ID J45m0mWNbe8
InChI InChI=1S/C13H11N5O/c1-18-16-13(15-17-18)14-12(19)11-8-4-6-9-5-2-3-7-10(9)11/h2-8H,1H3,(H,14,16,19)
InChIKey GGWSPBFOCOOWNC-UHFFFAOYSA-N
Mol Weight 253.26 g/mol
Molecular Formula C13H11N5O
Exact Mass 253.09636 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FKfCDlr8IxK
Name N-(2-Methyl-2H-tetraazol-5-yl)-1-naphthamide
Comments Computed using HOSE algorithm
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Exact Mass 253.096359993 u
Formula C13H11N5O
InChI InChI=1S/C13H11N5O/c1-18-16-13(15-17-18)14-12(19)11-8-4-6-9-5-2-3-7-10(9)11/h2-8H,1H3,(H,14,16,19)
InChIKey GGWSPBFOCOOWNC-UHFFFAOYSA-N
SMILES N(C1=NN(C)N=N1)C(C1=C2C(C=CC=C2)=CC=C1)=O