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butyric acid 2-[(2-amino-6-keto-3H-purin-9-yl)methoxy]ethyl ester
SpectraBase Compound ID 6VdIv7bf1qb
InChI InChI=1S/C12H17N5O4/c1-2-3-8(18)21-5-4-20-7-17-6-14-9-10(17)15-12(13)16-11(9)19/h6H,2-5,7H2,1H3,(H3,13,15,16,19)
InChIKey BZTJSAXWUKYHCI-UHFFFAOYSA-N
Mol Weight 295.3 g/mol
Molecular Formula C12H17N5O4
Exact Mass 295.128054 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1aPVmvmCHh1
Name butyric acid 2-[(2-amino-6-keto-3H-purin-9-yl)methoxy]ethyl ester
Compound Number 2C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H17N5O4
InChI InChI=1S/C12H17N5O4/c1-2-3-8(18)21-5-4-20-7-17-6-14-9-10(17)15-12(13)16-11(9)19/h6H,2-5,7H2,1H3,(H3,13,15,16,19)
InChIKey BZTJSAXWUKYHCI-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 295.298 g/mol
Solvent DMSO-D6
Source File Reference UWGE5026