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2-CHLORO-(2',3'-O-METHOXYMETHYLIDENE)-ADENOSINE
SpectraBase Compound ID 50KRLlQAyku
InChI InChI=1S/2C12H14ClN5O5/c2*1-20-12-22-6-4(2-19)21-10(7(6)23-12)18-3-15-5-8(14)16-11(13)17-9(5)18/h2*3-4,6-7,10,12,19H,2H2,1H3,(H2,14,16,17)/t2*4-,6-,7-,10-,12?/m00/s1
InChIKey NLGZXACNFZNPET-LOWJAKKTSA-N
Mol Weight 687.45 g/mol
Molecular Formula C24H28Cl2N10O10
Exact Mass 686.136693 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LOmTZOSRNWE
Name 2-CHLORO-(2',3'-O-METHOXYMETHYLIDENE)-ADENOSINE
Compound Number 3C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H28Cl2N10O10
InChI InChI=1S/2C12H14ClN5O5/c2*1-20-12-22-6-4(2-19)21-10(7(6)23-12)18-3-15-5-8(14)16-11(13)17-9(5)18/h2*3-4,6-7,10,12,19H,2H2,1H3,(H2,14,16,17)/t2*4-,6-,7-,10-,12?/m00/s1
InChIKey NLGZXACNFZNPET-LOWJAKKTSA-N
Literature Reference Author V.NAHUM,G.ZUENDORF,S.A.LEVESQUE,A.R.BEAUDOIN,G.REISER,B.FISC HER
Literature Reference Citation J.MED.CHEM.,45,5384(2002)
Literature Reference DOI 10.1021/jm020251d
Molecular Weight 687.453 g/mol
Sample ID 65665
Solvent CDCl3