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6-(3,3-Dimethyl-allylamino)-3-(3-phthalimido-propyl)-purine

View entire compound with spectra: 1 NMR

6-(3,3-Dimethyl-allylamino)-3-(3-phthalimido-propyl)-purine
SpectraBase Compound ID 5u4SIA06has
InChI InChI=1S/C21H22N6O2/c1-14(2)8-9-22-18-17-19(24-12-23-17)26(13-25-18)10-5-11-27-20(28)15-6-3-4-7-16(15)21(27)29/h3-4,6-8,12-13,22H,5,9-11H2,1-2H3
InChIKey JENGSBMOLNLAIK-UHFFFAOYSA-N
Mol Weight 390.45 g/mol
Molecular Formula C21H22N6O2
Exact Mass 390.180424 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 41houEh61zs
Name 6-(3,3-Dimethyl-allylamino)-3-(3-phthalimido-propyl)-purine
Comments HYDROBROMIDE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H22N6O2
InChI InChI=1S/C21H22N6O2/c1-14(2)8-9-22-18-17-19(24-12-23-17)26(13-25-18)10-5-11-27-20(28)15-6-3-4-7-16(15)21(27)29/h3-4,6-8,12-13,22H,5,9-11H2,1-2H3
InChIKey JENGSBMOLNLAIK-UHFFFAOYSA-N
Literature Reference F. Seela, D. Hasselmann, Chem. Ber. 112, 3072 (1979).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6