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5-(1-CYANAMIDO-2-CHLOROETHYL)-2'-DEOXYURIDINE

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5-(1-CYANAMIDO-2-CHLOROETHYL)-2'-DEOXYURIDINE
SpectraBase Compound ID 21oGfFIAVmB
InChI InChI=1S/2C12H15ClN4O5/c2*13-2-7(15-5-14)6-3-17(12(21)16-11(6)20)10-1-8(19)9(4-18)22-10/h2*3,7-10,15,18-19H,1-2,4H2,(H,16,20,21)/t7-,8+,9-,10-;7-,8-,9+,10+/m01/s1
InChIKey JQYQQTMJDNXSCZ-HRXDDIHESA-N
Mol Weight 661.46 g/mol
Molecular Formula C24H30Cl2N8O10
Exact Mass 660.146195 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3rtVu3JBI6b
Name 5-(1-CYANAMIDO-2-CHLOROETHYL)-2'-DEOXYURIDINE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H30Cl2N8O10
InChI InChI=1S/2C12H15ClN4O5/c2*13-2-7(15-5-14)6-3-17(12(21)16-11(6)20)10-1-8(19)9(4-18)22-10/h2*3,7-10,15,18-19H,1-2,4H2,(H,16,20,21)/t7-,8+,9-,10-;7-,8-,9+,10+/m01/s1
InChIKey JQYQQTMJDNXSCZ-HRXDDIHESA-N
Literature Reference Author R.KUMAR,D.RAI,S.K.SHARMA,H.A.SAFFRAN,R.BLUSH,D.L.J.TYRRELL
Literature Reference Citation J.MED.CHEM.,44,3531(2001)
Literature Reference DOI 10.1021/jm010226s
Molecular Weight 661.456 g/mol
Sample ID 40917
Solvent CD3OD