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2,6-DIAMINO-9-(2',3'-ISOPROPYLIDENE-BETA-D-RIBOFURANOSIDE)-5,8-DIAZA-7,9-DICARBA-PURINE
SpectraBase Compound ID BcbPLiXTOpU
InChI InChI=1S/C13H18N6O4/c1-13(2)22-7-5(3-20)21-8(9(7)23-13)6-10-17-11(14)18-12(15)19(10)4-16-6/h4-5,7-9,20H,3H2,1-2H3,(H4,14,15,17,18)/t5-,7-,8+,9-/m0/s1
InChIKey YXCDVKGFUCMNIP-DBNIFQIXSA-N
Mol Weight 322.33 g/mol
Molecular Formula C13H18N6O4
Exact Mass 322.138953 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IKrBgWogVHS
Name 2,6-DIAMINO-9-(2',3'-ISOPROPYLIDENE-BETA-D-RIBOFURANOSIDE)-5,8-DIAZA-7,9-DICARBA-PURINE
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H18N6O4
InChI InChI=1S/C13H18N6O4/c1-13(2)22-7-5(3-20)21-8(9(7)23-13)6-10-17-11(14)18-12(15)19(10)4-16-6/h4-5,7-9,20H,3H2,1-2H3,(H4,14,15,17,18)/t5-,7-,8+,9-/m0/s1
InChIKey YXCDVKGFUCMNIP-DBNIFQIXSA-N
Literature Reference Author B.HAN,Z.WANG,B.JAUN,R.KRISHNAMURTHY,A.ESCHENMOSER
Literature Reference Citation ORG.LETTERS,5,2071(2003)
Literature Reference DOI 10.1021/ol030043v
Molecular Weight 322.324 g/mol
Sample ID 48978
Solvent DMSO-D6