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1,8-DIBENZYL-3-FURFURYL-7-METHYL-XANTHINE
SpectraBase Compound ID Eer7698agnr
InChI InChI=1S/C25H22N4O3/c1-27-21(15-18-9-4-2-5-10-18)26-23-22(27)24(30)29(16-19-11-6-3-7-12-19)25(31)28(23)17-20-13-8-14-32-20/h2-14H,15-17H2,1H3
InChIKey QCVDXVYJHVZAQM-UHFFFAOYSA-N
Mol Weight 426.48 g/mol
Molecular Formula C25H22N4O3
Exact Mass 426.169191 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3cN9WWuxbxI
Name 1,8-DIBENZYL-3-FURFURYL-7-METHYL-XANTHINE
Compound Number 4 F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H22N4O3
InChI InChI=1S/C25H22N4O3/c1-27-21(15-18-9-4-2-5-10-18)26-23-22(27)24(30)29(16-19-11-6-3-7-12-19)25(31)28(23)17-20-13-8-14-32-20/h2-14H,15-17H2,1H3
InChIKey QCVDXVYJHVZAQM-UHFFFAOYSA-N
Literature Reference Author A.R.HERGUETA,M.J.FIGUEIRA,C.LOPEZ,O.CAAMANO,F.FERNANDEZ,J.E. RODRIGUEZ-BORGES
Literature Reference Citation CHEM.PHARM.BULL.,50,1379(2002)
Literature Reference DOI 10.1248/cpb.50.1379
Molecular Weight 426.475 g/mol
Solvent CDCl3
Source File Reference UWMS20107