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Betaine monohydrate
SpectraBase Compound ID XAdYGCfluL
InChI InChI=1S/C5H11NO2.H2O/c1-6(2,3)4-5(7)8;/h4H2,1-3H3;1H2
InChIKey NJZRLXNBGZBREL-UHFFFAOYSA-N
Mol Weight 135.16 g/mol
Molecular Formula C5H13NO3
Exact Mass 135.089543 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KKt2QVJ2atg
Name betanine, hydrate
Source of Sample The Matheson Company, Inc., East Rutherford, New Jersey
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H13NO3
InChI InChI=1S/C5H11NO2.H2O/c1-6(2,3)4-5(7)8;/h4H2,1-3H3;1H2
InChIKey NJZRLXNBGZBREL-UHFFFAOYSA-N
Instrument Name Varian A-60
Sadtler NMR Number 6845M
Solvent D2O
Synonyms AMMONIUM HYDROXIDE, /CARBOXY- METHYL/TRIMETHYL-, AMMONIUM HYDROXIDE, /CARBOXY- METHYL/TRIMETHYL-, INNER SALT, HYDRATE BETAINE, HYDRATE