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2,6-DIAMINO-9-[(2'S,3'S)-2',3'-DIHYDROXY-(1'R)-PYRROLIDINYL]-5,8-DIAZA-7,9-DICARBA-PURINE-DIHYDROCHLORIDE
SpectraBase Compound ID 3urcBzixNWO
InChI InChI=1S/C9H13N7O2.2ClH/c10-8-14-7-5(4-6(18)3(17)1-12-4)13-2-16(7)9(11)15-8;;/h2-4,6,12,17-18H,1H2,(H4,10,11,14,15);2*1H/q+2;;/p-2/t3-,4-,6+;;/m0../s1
InChIKey LNQPRGWVGJGZIA-OEVVBFPESA-L
Mol Weight 324.17 g/mol
Molecular Formula C9H15Cl2N7O2
Exact Mass 323.066428 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5QRAOEncR86
Name 2,6-DIAMINO-9-[(2'S,3'S)-2',3'-DIHYDROXY-(1'R)-PYRROLIDINYL]-5,8-DIAZA-7,9-DICARBA-PURINE-DIHYDROCHLORIDE
Compound Number 10B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H15Cl2N7O2
InChI InChI=1S/C9H13N7O2.2ClH/c10-8-14-7-5(4-6(18)3(17)1-12-4)13-2-16(7)9(11)15-8;;/h2-4,6,12,17-18H,1H2,(H4,10,11,14,15);2*1H/q+2;;/p-2/t3-,4-,6+;;/m0../s1
InChIKey LNQPRGWVGJGZIA-OEVVBFPESA-L
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 324.170 g/mol
Sample ID 48976
Solvent DMSO-D6