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[(E)-2-methyl-4-[[9-(oxan-2-yl)purin-6-yl]amino]but-2-enyl] dihydrogen phosphate
SpectraBase Compound ID HVaGOonDRH1
InChI InChI=1S/C15H22N5O5P/c1-11(8-25-26(21,22)23)5-6-16-14-13-15(18-9-17-14)20(10-19-13)12-4-2-3-7-24-12/h5,9-10,12H,2-4,6-8H2,1H3,(H,16,17,18)(H2,21,22,23)/b11-5+
InChIKey RZTXGCBNTFIUEA-VZUCSPMQSA-N
Mol Weight 383.34 g/mol
Molecular Formula C15H22N5O5P
Exact Mass 383.135856 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BaH2C2NCGFY
Name [(E)-2-methyl-4-[[9-(oxan-2-yl)purin-6-yl]amino]but-2-enyl] dihydrogen phosphate
Compound Number 18
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H20N5O5P
InChI InChI=1S/C15H22N5O5P/c1-11(8-25-26(21,22)23)5-6-16-14-13-15(18-9-17-14)20(10-19-13)12-4-2-3-7-24-12/h5,9-10,12H,2-4,6-8H2,1H3,(H,16,17,18)(H2,21,22,23)/b11-5+
InChIKey RZTXGCBNTFIUEA-VZUCSPMQSA-N
Literature Reference Author B.R.SHADID,H.C.VANDERPLAS,E.DEVROOM,G.A.VANDERMAREL,J.H.VANB OOM
Literature Reference Citation REC.TR.CH.P.-B.,106,509(1987)
Molecular Weight 381.328 g/mol
Solvent D2O
Source File Reference UWGB3871