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2-[(dimethylamino)methyl]-3-hydroxy-6-(hydroxymethyl)-4H-pyran-4-one, hydrochloride
SpectraBase Compound ID 2GDpixx5166
InChI InChI=1S/C9H13NO4.ClH/c1-10(2)4-8-9(13)7(12)3-6(5-11)14-8;/h3,11,13H,4-5H2,1-2H3;1H
InChIKey DFGSMEBOWDKKPG-UHFFFAOYSA-N
Mol Weight 235.67 g/mol
Molecular Formula C9H14ClNO4
Exact Mass 235.061136 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GaVXBQV75hY
Name 2-[(DIMETHYLAMINO)METHYL]-3-HYDROXY-6-(HYDROXYMETHYL)-4H-PYRAN-4-ONE, HYDROCHLORIDE
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H13NO4 HCl
InChI InChI=1S/C9H13NO4.ClH/c1-10(2)4-8-9(13)7(12)3-6(5-11)14-8;/h3,11,13H,4-5H2,1-2H3;1H
InChIKey DFGSMEBOWDKKPG-UHFFFAOYSA-N
Molecular Weight 235.67
Solvent Deuterium oxide; Reference=Dioxane Spectrometer= Varian CFT-20
Synonyms 4H-PYRAN-4-ONE, 2-//DIMETHYLAMINO/METHYL/-3-HYDROXY-6-/HYDROXYMETHYL/-, HYDROCHLORIDE