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1H-1,2,3,4-Tetrazol-5-amine, N-(1,3-benzodioxol-5-ylmethyl)-1-methyl-
SpectraBase Compound ID GIPQCYnCyit
InChI InChI=1S/C10H11N5O2/c1-15-10(12-13-14-15)11-5-7-2-3-8-9(4-7)17-6-16-8/h2-4H,5-6H2,1H3,(H,11,12,14)
InChIKey ZPSGBQKUMXPKFK-UHFFFAOYSA-N
Mol Weight 233.23 g/mol
Molecular Formula C10H11N5O2
Exact Mass 233.091275 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9mGurt6N033
Name 1H-1,2,3,4-Tetrazol-5-amine, N-(1,3-benzodioxol-5-ylmethyl)-1-methyl-
Comments Computed using HOSE algorithm
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Exact Mass 233.091274612 u
Formula C10H11N5O2
InChI InChI=1S/C10H11N5O2/c1-15-10(12-13-14-15)11-5-7-2-3-8-9(4-7)17-6-16-8/h2-4H,5-6H2,1H3,(H,11,12,14)
InChIKey ZPSGBQKUMXPKFK-UHFFFAOYSA-N
Molecular Weight 233.231 g/mol
SMILES C=1(N(C)N=NN1)NCC=1C=CC=2OCOC2C1