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2'-Deoxyinosine 5'-monophosphate disodium salt(14999-52-1) 13C NMR
Product Name2'-Deoxyinosine 5'-monophosphate disodium salt
CAS14999-52-1
Molecular FormulaC10H11N4Na2O7P
Molecular Weight376.17
InChIInChI=1/C10H13N4O7P.2Na/c15-5-1-7(21-6(5)2-20-22(17,18)19)14-4-13-8-9(14)11-3-12-10(8)16;;/h3-7,15H,1-2H2,(H,11,12,16)(H2,17,18,19);;/q;2*+1/p-2/t5-,6+,7+;;/s3
InChIKey VDPLPYMIJCLJEF-BPETZYGMNA-L
SmilesN1(C=NC2C(=O)NC=NC1=2)[C@H]1C[C@H](O)[C@@H](COP([O-])([O-])=O)O1.[Na+].[Na+] |&1:10,12,14,r|
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ppm Int. Assign.
159.16 323 1 148.91 242 2 146.78 800 3 140.44 302 4 124.06 197 5 87.30 491 P 6 86.93 499 P 6 84.54 916 7 71.94 1000 8 64.49 438 P 9 64.29 458 P 9 39.83 874 10Spectral Code: 13C NMR : in D2O
