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Betaine cation
SpectraBase Compound ID AEeH21wIpiL
InChI InChI=1S/C5H11NO2/c1-6(2,3)4-5(7)8/h4H2,1-3H3/p+1
InChIKey KWIUHFFTVRNATP-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 7xRQQXXa4HG
Name Betaine cation
CAS Registry Number 590-46-5
Comments chloride
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Formula C5H12NO2
InChI InChI=1S/C5H11NO2/c1-6(2,3)4-5(7)8/h4H2,1-3H3/p+1
InChIKey KWIUHFFTVRNATP-UHFFFAOYSA-O
Instrument Name Varian XL-100
NMR Standard Dioxane
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent D2O