John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=BUkQBj0gd9D SpectraBase Spectrum ID=1K65Mu3t0a8

(accessed ).
3-hydroxy-6-(hydroxymethyl)-2-[(1-pyrrolidinyl)methyl]-4H-pyran-4-one, hydrochloride
SpectraBase Compound ID BUkQBj0gd9D
InChI InChI=1S/C11H15NO4.ClH/c13-7-8-5-9(14)11(15)10(16-8)6-12-3-1-2-4-12;/h5,13,15H,1-4,6-7H2;1H
InChIKey HCNMJBMXAMWFSU-UHFFFAOYSA-N
Mol Weight 261.7 g/mol
Molecular Formula C11H16ClNO4
Exact Mass 261.076786 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1K65Mu3t0a8
Name 3-HYDROXY-6-(HYDROXYMETHYL)-2-[(1-PYRROLIDINYL)METHYL]-4H-PYRAN-4-ONE,HYDROCHLORIDE
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Copyright Copyright © 1980, 1981-2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H15NO4 HCl
InChI InChI=1S/C11H15NO4.ClH/c13-7-8-5-9(14)11(15)10(16-8)6-12-3-1-2-4-12;/h5,13,15H,1-4,6-7H2;1H
InChIKey HCNMJBMXAMWFSU-UHFFFAOYSA-N
Molecular Weight 261.71
Solvent Deuterium oxide; Reference=Dioxane Spectrometer= Varian CFT-20
SpectraBase Batch ID ECV3xymsoRe
Synonyms KOJIC ACID, 6-//1-PYRROLIDINYL/METHYL/-, HYDROCHLORIDE 4H-PYRAN-4-ONE, 3-HYDROXY-6-/HYDROXYMETHYL/-2-//1-PYRROLIDINYL/METHYL/-, HYDROCHLORIDE