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1-[[4,5-BIS-(HEXYLOXY)-9,10-DIOXO-9,10-DIHYDRO-ANTHRACEN-2-YL]-METHYL]-5-FLUORO-PYRIMIDINE-2,4(1H,3H)-DIONE

View entire compound with spectra: 1 NMR

1-[[4,5-BIS-(HEXYLOXY)-9,10-DIOXO-9,10-DIHYDRO-ANTHRACEN-2-YL]-METHYL]-5-FLUORO-PYRIMIDINE-2,4(1H,3H)-DIONE
SpectraBase Compound ID G1ETLJwFcSY
InChI InChI=1S/C31H35FN2O6/c1-3-5-7-9-14-39-24-13-11-12-21-26(24)29(36)27-22(28(21)35)16-20(17-25(27)40-15-10-8-6-4-2)18-34-19-23(32)30(37)33-31(34)38/h11-13,16-17,19H,3-10,14-15,18H2,1-2H3,(H,33,37,38)
InChIKey BWQKJDJEWYPXDA-UHFFFAOYSA-N
Mol Weight 550.6 g/mol
Molecular Formula C31H35FN2O6
Exact Mass 550.247915 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DwDNK5xcu2O
Name 1-[[4,5-BIS-(HEXYLOXY)-9,10-DIOXO-9,10-DIHYDRO-ANTHRACEN-2-YL]-METHYL]-5-FLUORO-PYRIMIDINE-2,4(1H,3H)-DIONE
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H35FN2O6
InChI InChI=1S/C31H35FN2O6/c1-3-5-7-9-14-39-24-13-11-12-21-26(24)29(36)27-22(28(21)35)16-20(17-25(27)40-15-10-8-6-4-2)18-34-19-23(32)30(37)33-31(34)38/h11-13,16-17,19H,3-10,14-15,18H2,1-2H3,(H,33,37,38)
InChIKey BWQKJDJEWYPXDA-UHFFFAOYSA-N
Literature Reference Author X.R.CUI,R.SAITO,T.KUBO,D.KON,Y.HIRANO,S.SAITO
Literature Reference Citation CHEM.PHARM.BULL.,59,302(2011)
Literature Reference DOI 10.1248/cpb.59.302
Molecular Weight 550.627 g/mol
Sample ID 2707
Solvent CDCl3