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9H-Purine, 2-(methylsulfonyl)-9-[2,3,5-tris-O-[(1,1-dimethylethyl)dimethylsilyl]-.beta.-D-ribofuranosyl]-
SpectraBase Compound ID 6gdjvhYCJn8
InChI InChI=1S/C29H56N4O6SSi3/c1-27(2,3)41(11,12)36-18-21-22(38-42(13,14)28(4,5)6)23(39-43(15,16)29(7,8)9)25(37-21)33-19-31-20-17-30-26(32-24(20)33)40(10,34)35/h17,19,21-23,25H,18H2,1-16H3/t21-,22-,23-,25-/m1/s1
InChIKey WWJOTJYFIYPVHL-VWBWNGLSSA-N
Mol Weight 673.1 g/mol
Molecular Formula C29H56N4O6SSi3
Exact Mass 672.322836 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fu7dacVxmXS
Name 9H-Purine, 2-(methylsulfonyl)-9-[2,3,5-tris-O-[(1,1-dimethylethyl)dimethylsilyl]-.beta.-D-ribofuranosyl]-
Alternate Name(s) 2-Methylsulfonyl-9(2,3,5-tri-O-(2-methylprop-2-yl)dimethylsilyloxy-.beta.-D-ribofuranosyl)purine 9-[(2R,3R,4R,5R)-3,4-bis[(tert-butyldimethylsilyl)oxy]-5-{[(tert-butyldimethylsilyl)oxy]methyl}oxolan-2-yl]-2-methanesulfonyl-9H-purine
CAS Registry Number 121358-22-3
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H56N4O6SSi3
InChI InChI=1S/C29H56N4O6SSi3/c1-27(2,3)41(11,12)36-18-21-22(38-42(13,14)28(4,5)6)23(39-43(15,16)29(7,8)9)25(37-21)33-19-31-20-17-30-26(32-24(20)33)40(10,34)35/h17,19,21-23,25H,18H2,1-16H3/t21-,22-,23-,25-/m1/s1
InChIKey WWJOTJYFIYPVHL-VWBWNGLSSA-N
Molecular Weight 673.104 g/mol
SMILES [C@@]1([n]2c3nc(S(=O)(=O)C)ncc3nc2)([C@@]([C@](O[Si](C(C)(C)C)(C)C)([C@](O1)(CO[Si](C(C)(C)C)(C)C)[H])[H])(O[Si](C(C)(C)C)(C)C)[H])[H]
SPLASH splash10-014i-0000009000-9a7c71842770ccf28490
Source of Spectrum F-44-7004-7
Wiley ID 1413982