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4-HYDROXY-6-(HYDROXY-PHENYL-METHYL)-N-(3-METHYL-BUTYRYL)-NICOTINAMIDE
SpectraBase Compound ID 4WceuA4SxXE
InChI InChI=1S/C18H20N2O4/c1-11(2)8-16(22)20-18(24)13-10-19-14(9-15(13)21)17(23)12-6-4-3-5-7-12/h3-7,9-11,17,23H,8H2,1-2H3,(H,19,21)(H,20,22,24)
InChIKey RTBJNIQHGYLJIR-UHFFFAOYSA-N
Mol Weight 328.37 g/mol
Molecular Formula C18H20N2O4
Exact Mass 328.142307 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HCny3BSD8hy
Name 4-HYDROXY-6-(HYDROXY-PHENYL-METHYL)-N-(3-METHYL-BUTYRYL)-NICOTINAMIDE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H20N2O4
InChI InChI=1S/C18H20N2O4/c1-11(2)8-16(22)20-18(24)13-10-19-14(9-15(13)21)17(23)12-6-4-3-5-7-12/h3-7,9-11,17,23H,8H2,1-2H3,(H,19,21)(H,20,22,24)
InChIKey RTBJNIQHGYLJIR-UHFFFAOYSA-N
Literature Reference Author Y.CHEN,C.SHAO,Z.HUANG,Y.ZHANG,X.CAI,Z.SHE,S.ZHOU,Y.LIN
Literature Reference Citation MAGN.RES.CHEM.,47,92(2009)
Literature Reference DOI 10.1002/mrc.2346
Molecular Weight 328.368 g/mol
Solvent DMSO-D6
Source File Reference UWLU79377