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2-[6-[di(phenyl)carbamoyloxy]-2-(isobutyrylamino)purin-9-yl]acetic acid methyl ester

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2-[6-[di(phenyl)carbamoyloxy]-2-(isobutyrylamino)purin-9-yl]acetic acid methyl ester
SpectraBase Compound ID 3w4PRf1K4UW
InChI InChI=1S/C25H24N6O5/c1-16(2)22(33)28-24-27-21-20(26-15-30(21)14-19(32)35-3)23(29-24)36-25(34)31(17-10-6-4-7-11-17)18-12-8-5-9-13-18/h4-13,15-16H,14H2,1-3H3,(H,27,28,29,33)
InChIKey YSLUWJOYBYJURM-UHFFFAOYSA-N
Mol Weight 488.5 g/mol
Molecular Formula C25H24N6O5
Exact Mass 488.180818 g/mol

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1EVo3dmRrMT
Name 2-[6-[di(phenyl)carbamoyloxy]-2-(isobutyrylamino)purin-9-yl]acetic acid methyl ester
Compound Number 5A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H24N6O5
InChI InChI=1S/C25H24N6O5/c1-16(2)22(33)28-24-27-21-20(26-15-30(21)14-19(32)35-3)23(29-24)36-25(34)31(17-10-6-4-7-11-17)18-12-8-5-9-13-18/h4-13,15-16H,14H2,1-3H3,(H,27,28,29,33)
InChIKey YSLUWJOYBYJURM-UHFFFAOYSA-N
Literature Reference Author R.MAREK,J.BRUS,J.TOUSEK,L.KOVACS,D.HOCKOVA
Literature Reference Citation MAGN.RES.CHEM.,40,353(2002)
Literature Reference DOI 10.1002/mrc.1020
Solvent DMSO-D6
Source File Reference UWMZ21133