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Valyl-alanine cation
SpectraBase Compound ID 4UnhVnK8AcE
InChI InChI=1S/C8H16N2O3/c1-4(2)6(9)7(11)10-5(3)8(12)13/h4-6H,9H2,1-3H3,(H,10,11)(H,12,13)/p+1
InChIKey HSRXSKHRSXRCFC-UHFFFAOYSA-O
Mol Weight 189.24 g/mol
Molecular Formula C8H17N2O3
Exact Mass 189.123917 g/mol

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8KNztIY0kQH
Name Valyl-alanine cation
Comments LOCK:DNO3 ENRICHED,H2O 0.2M
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Formula C8H17N2O3
InChI InChI=1S/C8H16N2O3/c1-4(2)6(9)7(11)10-5(3)8(12)13/h4-6H,9H2,1-3H3,(H,10,11)(H,12,13)/p+1
InChIKey HSRXSKHRSXRCFC-UHFFFAOYSA-O
Instrument Name Bruker WH-180
Literature Reference T.B. Posner et. al., J. Chem. Soc. Chem. Comm. 769 (1975).
NMR Standard CH3NO2
Observed nucleus 15N
Solvent H2O