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Valine cation
SpectraBase Compound ID Jm7gVRhkX46
InChI InChI=1S/C5H11NO2/c1-3(2)4(6)5(7)8/h3-4H,6H2,1-2H3,(H,7,8)/p+1
InChIKey KZSNJWFQEVHDMF-UHFFFAOYSA-O
Mol Weight 118.16 g/mol
Molecular Formula C5H12NO2
Exact Mass 118.086804 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AjSWPQAOTiO
Name Valine cation
Comments PH 0.9
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Formula C5H12NO2
InChI InChI=1S/C5H11NO2/c1-3(2)4(6)5(7)8/h3-4H,6H2,1-2H3,(H,7,8)/p+1
InChIKey KZSNJWFQEVHDMF-UHFFFAOYSA-O
Instrument Name Varian XL-100
Literature Reference S. Tran-Dinh, P. Promageot, J. Am. Chem. Soc. 96, 1484 (1974).
NMR Standard TMS Ext.
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent D2O