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2',3'-O-ISOPROPYLIDENE-5'-O-[3-[(TOL-4-YL)-SULFONYLOXY]-PROPYL]-ADENOSINE
SpectraBase Compound ID 233rOUDYrIF
InChI InChI=1S/C23H29N5O7S/c1-14-5-7-15(8-6-14)36(29,30)32-10-4-9-31-11-16-18-19(35-23(2,3)34-18)22(33-16)28-13-27-17-20(24)25-12-26-21(17)28/h5-8,12-13,16,18-19,22H,4,9-11H2,1-3H3,(H2,24,25,26)/t16-,18-,19-,22-/m0/s1
InChIKey MBLJOKYTOYLMIO-FUOQNJDISA-N
Mol Weight 519.57 g/mol
Molecular Formula C23H29N5O7S
Exact Mass 519.178769 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ih2dMPOSaDF
Name 2',3'-O-ISOPROPYLIDENE-5'-O-[3-[(TOL-4-YL)-SULFONYLOXY]-PROPYL]-ADENOSINE
Compound Number 11A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H29N5O7S
InChI InChI=1S/C23H29N5O7S/c1-14-5-7-15(8-6-14)36(29,30)32-10-4-9-31-11-16-18-19(35-23(2,3)34-18)22(33-16)28-13-27-17-20(24)25-12-26-21(17)28/h5-8,12-13,16,18-19,22H,4,9-11H2,1-3H3,(H2,24,25,26)/t16-,18-,19-,22-/m0/s1
InChIKey MBLJOKYTOYLMIO-FUOQNJDISA-N
Literature Reference Author L.POPPE,W.E.HULL,J.RETEY
Literature Reference Citation HELV.CHIM.ACTA,76,2367(1993)
Literature Reference DOI 10.1002/hlca.19930760623
Molecular Weight 519.573 g/mol
Solvent CDCl3
Source File Reference UWSK25