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3,3'-(3-PHENYLPROPANE-1,1-DIYL)-BIS-[4-HYDROXY-6-METHYL-PYRIDIN-2(1H)-ONE]
SpectraBase Compound ID E2wRJyfFjxs
InChI InChI=1S/C21H22N2O4/c1-12-10-16(24)18(20(26)22-12)15(9-8-14-6-4-3-5-7-14)19-17(25)11-13(2)23-21(19)27/h3-7,10-11,15H,8-9H2,1-2H3,(H2,22,24,26)(H2,23,25,27)
InChIKey OFIMZOFNGYQZMA-UHFFFAOYSA-N
Mol Weight 366.42 g/mol
Molecular Formula C21H22N2O4
Exact Mass 366.157957 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5PS17oqCcFp
Name 3,3'-(3-PHENYLPROPANE-1,1-DIYL)-BIS-[4-HYDROXY-6-METHYL-PYRIDIN-2(1H)-ONE]
Compound Number 4F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H22N2O4
InChI InChI=1S/C21H22N2O4/c1-12-10-16(24)18(20(26)22-12)15(9-8-14-6-4-3-5-7-14)19-17(25)11-13(2)23-21(19)27/h3-7,10-11,15H,8-9H2,1-2H3,(H2,22,24,26)(H2,23,25,27)
InChIKey OFIMZOFNGYQZMA-UHFFFAOYSA-N
Literature Reference Author A.J.DEMUNER,V.M.M.VALENTE,L.C.A.BARBOSA,A.H.RATHI,T.J.DONOHO E,A.L.THOMPSON
Literature Reference Citation MOLECULES,14,4973(2009)
Literature Reference DOI 10.3390/molecules14124973
Molecular Weight 366.417 g/mol
Sample ID 70049
Solvent DMSO-D6