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[1-(15)-N,6-(15)-NH2]-N-(6)-BENZOYLADENOSINE

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[1-(15)-N,6-(15)-NH2]-N-(6)-BENZOYLADENOSINE
SpectraBase Compound ID 1sxalZfdPO4
InChI InChI=1S/C17H17N5O5/c23-6-10-12(24)13(25)17(27-10)22-8-20-11-14(18-7-19-15(11)22)21-16(26)9-4-2-1-3-5-9/h1-5,7-8,10,12-13,17,23-25H,6H2,(H,18,19,21,26)/t10-,12-,13-,17-/m1/s1/i18+1,21+1
InChIKey NZDWTKFDAUOODA-CQIRIUEISA-N
Mol Weight 373.34 g/mol
Molecular Formula C17H17N315N2O5
Exact Mass 373.117038 g/mol

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CoqVo2KOWuu
Name [1-(15)-N,6-(15)-NH2]-N-(6)-BENZOYLADENOSINE
Compound Number 5**
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H17N315N2O5
InChI InChI=1S/C17H17N5O5/c23-6-10-12(24)13(25)17(27-10)22-8-20-11-14(18-7-19-15(11)22)21-16(26)9-4-2-1-3-5-9/h1-5,7-8,10,12-13,17,23-25H,6H2,(H,18,19,21,26)/t10-,12-,13-,17-/m1/s1/i18+1,21+1
InChIKey NZDWTKFDAUOODA-CQIRIUEISA-N
Literature Reference Author M.TERRAZAS,X.ARIZA,J.FARRAS,J.M.GUISADO-YANG,J.VILARRASA
Literature Reference Citation J.ORG.CHEM.,69,5473(2004)
Literature Reference DOI 10.1021/jo049490u
Solvent DMSO-D6
Source File Reference UWVN22139