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valeric acid 2-[(2-amino-6-keto-3H-purin-9-yl)methoxy]ethyl ester
SpectraBase Compound ID GP6qoP9x49D
InChI InChI=1S/C13H19N5O4/c1-2-3-4-9(19)22-6-5-21-8-18-7-15-10-11(18)16-13(14)17-12(10)20/h7H,2-6,8H2,1H3,(H3,14,16,17,20)
InChIKey KMTZFYVMJZEGTJ-UHFFFAOYSA-N
Mol Weight 309.33 g/mol
Molecular Formula C13H19N5O4
Exact Mass 309.143704 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HEDwrXdxNwG
Name valeric acid 2-[(2-amino-6-keto-3H-purin-9-yl)methoxy]ethyl ester
Compound Number 2E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H19N5O4
InChI InChI=1S/C13H19N5O4/c1-2-3-4-9(19)22-6-5-21-8-18-7-15-10-11(18)16-13(14)17-12(10)20/h7H,2-6,8H2,1H3,(H3,14,16,17,20)
InChIKey KMTZFYVMJZEGTJ-UHFFFAOYSA-N
Literature Reference Author H.GAO,A.K.MITRA
Literature Reference Citation MAGN.RES.CHEM.,37,687(1999)
Literature Reference DOI 10.1002/(sici)1097-458x(199909)37:9<687::aid-mrc510>3.0.co;2-k
Molecular Weight 309.325 g/mol
Solvent DMSO-D6
Source File Reference UWGE5028