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8-BENZYL-1-PHENYL-7-METHYL-3-PROPYL-XANTHINE

View entire compound with spectra: 1 NMR

8-BENZYL-1-PHENYL-7-METHYL-3-PROPYL-XANTHINE
SpectraBase Compound ID Ez5iY9MREQ6
InChI InChI=1S/C22H22N4O2/c1-3-14-25-20-19(21(27)26(22(25)28)17-12-8-5-9-13-17)24(2)18(23-20)15-16-10-6-4-7-11-16/h4-13H,3,14-15H2,1-2H3
InChIKey GZZDXNPFYXDMLH-UHFFFAOYSA-N
Mol Weight 374.44 g/mol
Molecular Formula C22H22N4O2
Exact Mass 374.174276 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3S3ml9nBrvU
Name 8-BENZYL-1-PHENYL-7-METHYL-3-PROPYL-XANTHINE
Compound Number 4H
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H22N4O2
InChI InChI=1S/C22H22N4O2/c1-3-14-25-20-19(21(27)26(22(25)28)17-12-8-5-9-13-17)24(2)18(23-20)15-16-10-6-4-7-11-16/h4-13H,3,14-15H2,1-2H3
InChIKey GZZDXNPFYXDMLH-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 374.442 g/mol
Solvent CDCl3
Source File Reference UWMS20109