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2-[[(6-AMINO-9H-PURIN-9-YL)-(PYRROLIDIN-1-YL)-METHYLIDEN]-AMINO)-3,3-DICYANOACRYLIC-ACID,ETHYLESTER
SpectraBase Compound ID C1OnvBIahxJ
InChI InChI=1S/C17H17N9O2/c1-2-28-16(27)12(11(7-18)8-19)24-17(25-5-3-4-6-25)26-10-23-13-14(20)21-9-22-15(13)26/h9-10H,2-6H2,1H3,(H2,20,21,22)/b24-17+
InChIKey DFDHFTCDLKGYMM-JJIBRWJFSA-N
Mol Weight 379.38 g/mol
Molecular Formula C17H17N9O2
Exact Mass 379.150521 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4LxrJoBo96h
Name 2-[[(6-AMINO-9H-PURIN-9-YL)-(PYRROLIDIN-1-YL)-METHYLIDEN]-AMINO)-3,3-DICYANOACRYLIC-ACID,ETHYLESTER
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H17N9O2
InChI InChI=1S/C17H17N9O2/c1-2-28-16(27)12(11(7-18)8-19)24-17(25-5-3-4-6-25)26-10-23-13-14(20)21-9-22-15(13)26/h9-10H,2-6H2,1H3,(H2,20,21,22)/b24-17+
InChIKey DFDHFTCDLKGYMM-JJIBRWJFSA-N
Literature Reference Author W.RIED,H.WOITHE
Literature Reference Citation HELV.CHIM.ACTA,72,1860(1989)
Literature Reference DOI 10.1002/hlca.19890720823
Molecular Weight 379.381 g/mol
Solvent DMSO-D6
Source File Reference UWED11101