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5-methyl-1-[(1S,3R)-3-[tri(phenyl)methoxymethyl]cyclopentyl]pyrimidine-2,4-quinone
SpectraBase Compound ID 1QZT2j0aV6d
InChI InChI=1S/C30H30N2O3/c1-22-20-32(29(34)31-28(22)33)27-18-17-23(19-27)21-35-30(24-11-5-2-6-12-24,25-13-7-3-8-14-25)26-15-9-4-10-16-26/h2-16,20,23,27H,17-19,21H2,1H3,(H,31,33,34)/t23-,27+/m1/s1
InChIKey HUJWFBBVAPIFFI-KCWPFWIISA-N
Mol Weight 466.58 g/mol
Molecular Formula C30H30N2O3
Exact Mass 466.225643 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5kXrdTyoaar
Name 5-methyl-1-[(1S,3R)-3-[tri(phenyl)methoxymethyl]cyclopentyl]pyrimidine-2,4-quinone
Compound Number 20
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H30N2O3
InChI InChI=1S/C30H30N2O3/c1-22-20-32(29(34)31-28(22)33)27-18-17-23(19-27)21-35-30(24-11-5-2-6-12-24,25-13-7-3-8-14-25)26-15-9-4-10-16-26/h2-16,20,23,27H,17-19,21H2,1H3,(H,31,33,34)/t23-,27+/m1/s1
InChIKey HUJWFBBVAPIFFI-KCWPFWIISA-N
Literature Reference Author O.R.LUDEK,J.BALZARINI,C.MEIER
Literature Reference Citation EUR.J.ORG.CHEM.,932(2006)
Molecular Weight 466.580 g/mol
Sample ID 43330
Solvent C6D6