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1-Triazene-1-carboxylic acid, 3,3-diethyl-, 1-methylethyl ester
SpectraBase Compound ID D4yJHi1FUw4
InChI InChI=1S/C8H17N3O2/c1-5-11(6-2)10-9-8(12)13-7(3)4/h7H,5-6H2,1-4H3/b10-9+
InChIKey KFMXAFJOPCZGIW-MDZDMXLPSA-N
Mol Weight 187.24 g/mol
Molecular Formula C8H17N3O2
Exact Mass 187.132077 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 56NV57ZOU1k
Name 1-Triazene-1-carboxylic acid, 3,3-diethyl-, 1-methylethyl ester
Comments Computed using HOSE algorithm
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Exact Mass 187.132076797 u
Formula C8H17N3O2
InChI InChI=1S/C8H17N3O2/c1-5-11(6-2)10-9-8(12)13-7(3)4/h7H,5-6H2,1-4H3/b10-9+
InChIKey KFMXAFJOPCZGIW-MDZDMXLPSA-N
Molecular Weight 187.243 g/mol
SMILES C(N(\N=N\C(=O)OC(C)C)CC)C