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3-BENZOYL-5-METHYL-1-[(4,5,7-TRIMETHOXY-9,10-DIOXO-9,10-DIHYDROANTHRACEN-2-YL)-METHYL]-PYRIMIDINE-2,4(1H,3H)-DIONE
SpectraBase Compound ID LPbPxA5vRtr
InChI InChI=1S/C30H24N2O8/c1-16-14-31(30(37)32(28(16)35)29(36)18-8-6-5-7-9-18)15-17-10-20-24(22(11-17)39-3)27(34)25-21(26(20)33)12-19(38-2)13-23(25)40-4/h5-14H,15H2,1-4H3
InChIKey KXMNNIFQPWEMMS-UHFFFAOYSA-N
Mol Weight 540.53 g/mol
Molecular Formula C30H24N2O8
Exact Mass 540.153266 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IrxuEvgYKyC
Name 3-BENZOYL-5-METHYL-1-[(4,5,7-TRIMETHOXY-9,10-DIOXO-9,10-DIHYDROANTHRACEN-2-YL)-METHYL]-PYRIMIDINE-2,4(1H,3H)-DIONE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H24N2O8
InChI InChI=1S/C30H24N2O8/c1-16-14-31(30(37)32(28(16)35)29(36)18-8-6-5-7-9-18)15-17-10-20-24(22(11-17)39-3)27(34)25-21(26(20)33)12-19(38-2)13-23(25)40-4/h5-14H,15H2,1-4H3
InChIKey KXMNNIFQPWEMMS-UHFFFAOYSA-N
Literature Reference Author D.GEIBLMEIR,H.FALK
Literature Reference Citation MH.CHEM.,139,1127(2008)
Literature Reference DOI 10.1007/s00706-008-0898-0
Molecular Weight 540.529 g/mol
Sample ID 40082
Solvent DMSO-D6