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2H-1,2,3,4-Tetrazole-2-acetamide, N-methyl-5-phenyl-
SpectraBase Compound ID EqOfeRDoJnU
InChI InChI=1S/C10H11N5O/c1-11-9(16)7-15-13-10(12-14-15)8-5-3-2-4-6-8/h2-6H,7H2,1H3,(H,11,16)
InChIKey KIRHLKZCFRURGC-UHFFFAOYSA-N
Mol Weight 217.23 g/mol
Molecular Formula C10H11N5O
Exact Mass 217.09636 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5UebcJVmvnY
Name 2H-1,2,3,4-Tetrazole-2-acetamide, N-methyl-5-phenyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 217.096359993 u
Formula C10H11N5O
InChI InChI=1S/C10H11N5O/c1-11-9(16)7-15-13-10(12-14-15)8-5-3-2-4-6-8/h2-6H,7H2,1H3,(H,11,16)
InChIKey KIRHLKZCFRURGC-UHFFFAOYSA-N
Molecular Weight 217.232 g/mol
SMILES C1=CC(C=2N=NN(N2)CC(NC)=O)=CC=C1