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3,5-dibromo-2-methoxy-N-(2-propyl-2H-tetraazol-5-yl)benzamide

View entire compound with spectra: 2 NMR

3,5-dibromo-2-methoxy-N-(2-propyl-2H-tetraazol-5-yl)benzamide
SpectraBase Compound ID DhgLHHnuVKI
InChI InChI=1S/C12H13Br2N5O2/c1-3-4-19-17-12(16-18-19)15-11(20)8-5-7(13)6-9(14)10(8)21-2/h5-6H,3-4H2,1-2H3,(H,15,17,20)
InChIKey UMXYSLQMYKQEEQ-UHFFFAOYSA-N
Mol Weight 419.08 g/mol
Molecular Formula C12H13Br2N5O2
Exact Mass 416.943601 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JuoDtU4DOBb
Name 3,5-Dibromo-2-methoxy-N-(2-propyl-2H-tetraazol-5-yl)benzamide
Comments Computed using HOSE algorithm
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Exact Mass 416.943600677 u
Formula C12H13Br2N5O2
InChI InChI=1S/C12H13Br2N5O2/c1-3-4-19-17-12(16-18-19)15-11(20)8-5-7(13)6-9(14)10(8)21-2/h5-6H,3-4H2,1-2H3,(H,15,17,20)
InChIKey UMXYSLQMYKQEEQ-UHFFFAOYSA-N
Molecular Weight 419.077 g/mol
SMILES N(C(C=1C(=C(Br)C=C(C1)Br)OC)=O)C1=NN(CCC)N=N1