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2,6-Diiodo-9.beta-(2,3,5-tri-O-acetyl-D-ribofuranosyl)purine
SpectraBase Compound ID 6mlqoGwSWVL
InChI InChI=1S/C16H16I2N4O7/c1-6(23)26-4-9-11(27-7(2)24)12(28-8(3)25)15(29-9)22-5-19-10-13(17)20-16(18)21-14(10)22/h5,9,11-12,15H,4H2,1-3H3/t9-,11-,12-,15?/m1/s1
InChIKey APPPJARIZVNFFO-FJFSNTMWSA-N
Mol Weight 630.13 g/mol
Molecular Formula C16H16I2N4O7
Exact Mass 629.910839 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 30aVdw26fyu
Name 2,6-Diiodo-9.beta-(2,3,5-tri-O-acetyl-D-ribofuranosyl)purine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16I2N4O7
InChI InChI=1S/C16H16I2N4O7/c1-6(23)26-4-9-11(27-7(2)24)12(28-8(3)25)15(29-9)22-5-19-10-13(17)20-16(18)21-14(10)22/h5,9,11-12,15H,4H2,1-3H3/t9-,11-,12-,15?/m1/s1
InChIKey APPPJARIZVNFFO-FJFSNTMWSA-N
Molecular Weight 630.134 g/mol
SMILES c12[n](cnc2c(I)nc(n1)I)C1[C@@]([C@](OC(=O)C)([C@](O1)(COC(=O)C)[H])[H])(OC(=O)C)[H]
SPLASH splash10-052r-0931000000-2f1bf6080a2bda086e6d
Source of Spectrum J-50-408-6
Synonyms 2,6-Diiodo-9..beta.-(2,3,5-tri-O-acetyl-D-ribofuranosyl)purine [(2R,3R,4R)-3,4-bis(acetyloxy)-5-(2,6-diiodo-9H-purin-9-yl)oxolan-2-yl]methyl acetate
Wiley ID 1412065