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N-[4-(aminosulfonyl)phenyl]-2-(1H-tetraazol-1-yl)acetamide
SpectraBase Compound ID Ew2MUph6hD1
InChI InChI=1S/C9H10N6O3S/c10-19(17,18)8-3-1-7(2-4-8)12-9(16)5-15-6-11-13-14-15/h1-4,6H,5H2,(H,12,16)(H2,10,17,18)
InChIKey FCYSQZRUPZOKRI-UHFFFAOYSA-N
Mol Weight 282.28 g/mol
Molecular Formula C9H10N6O3S
Exact Mass 282.053509 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Hqi9tIJgCLA
Name N-[4-(Aminosulfonyl)phenyl]-2-(1H-tetraazol-1-yl)acetamide
Comments Computed using HOSE algorithm
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Exact Mass 282.053509377 u
Formula C9H10N6O3S
InChI InChI=1S/C9H10N6O3S/c10-19(17,18)8-3-1-7(2-4-8)12-9(16)5-15-6-11-13-14-15/h1-4,6H,5H2,(H,12,16)(H2,10,17,18)
InChIKey FCYSQZRUPZOKRI-UHFFFAOYSA-N
SMILES N(C(CN1N=NN=C1)=O)C1=CC=C(S(=O)(=O)N)C=C1