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[(Pyridine-4-carbonyl)-amino]-acetic acid, ethyl ester
SpectraBase Compound ID 5IEQLlkqxGY
InChI InChI=1S/C10H12N2O3/c1-2-15-9(13)7-12-10(14)8-3-5-11-6-4-8/h3-6H,2,7H2,1H3,(H,12,14)
InChIKey UKSITIYNEBPVGV-UHFFFAOYSA-N
Mol Weight 208.22 g/mol
Molecular Formula C10H12N2O3
Exact Mass 208.084792 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Hq2fOdQdUO6
Name [(Pyridine-4-carbonyl)-amino]-acetic acid, ethyl ester
Comments Computed using HOSE algorithm
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Exact Mass 208.084792251 u
Formula C10H12N2O3
InChI InChI=1S/C10H12N2O3/c1-2-15-9(13)7-12-10(14)8-3-5-11-6-4-8/h3-6H,2,7H2,1H3,(H,12,14)
InChIKey UKSITIYNEBPVGV-UHFFFAOYSA-N
Molecular Weight 208.217 g/mol
SMILES C(NCC(=O)OCC)(=O)C=1C=CN=CC1