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Alanine methyl ester cation
SpectraBase Compound ID 6I5DZrEeDqm
InChI InChI=1S/C4H9NO2/c1-3(5)4(6)7-2/h3H,5H2,1-2H3/p+1
InChIKey DWKPPFQULDPWHX-UHFFFAOYSA-O
Mol Weight 104.13 g/mol
Molecular Formula C4H10NO2
Exact Mass 104.071154 g/mol

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1XnqJPVYMO
Name Alanine methyl ester cation
CAS Registry Number 14316-06-4
Comments PH<2
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Formula C4H10NO2
InChI InChI=1S/C4H9NO2/c1-3(5)4(6)7-2/h3H,5H2,1-2H3/p+1
InChIKey DWKPPFQULDPWHX-UHFFFAOYSA-O
Literature Reference P.S. Pregosin, E.W. Randall, A.I.White, J. Chem. Soc. Chem. Comm. 1602 (1971).
NMR Standard CH3NO2
Observed nucleus 15N
Solvent H2O