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3H-Purine-3-butanoic acid, 6-[(3-methyl-2-butenyl)amino]-
SpectraBase Compound ID 1KYFRgNbWOT
InChI InChI=1S/C14H19N5O2/c1-10(2)5-6-15-13-12-14(17-8-16-12)19(9-18-13)7-3-4-11(20)21/h5,8-9,15H,3-4,6-7H2,1-2H3,(H,20,21)
InChIKey NNYOYWKDADWULD-UHFFFAOYSA-N
Mol Weight 289.34 g/mol
Molecular Formula C14H19N5O2
Exact Mass 289.153875 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6HWthGTNKf6
Name 3-(3-Carboxypropyl)-6-(3,3-dimethyl-allylamino)-purine
CAS Registry Number 72086-63-6
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C14H19N5O2
InChI InChI=1S/C14H19N5O2/c1-10(2)5-6-15-13-12-14(17-8-16-12)19(9-18-13)7-3-4-11(20)21/h5,8-9,15H,3-4,6-7H2,1-2H3,(H,20,21)
InChIKey NNYOYWKDADWULD-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 D6-DMSO + DCL