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RAC-N(6)-BENZOYL-2',3',5'-TRIDEOXY-3',5'-(METHANOSULFONYLMETHANO)-1'-A-CARBAADENOSINE;N(6)-BENZOYL-9-(TRANS-2,2-DIOXOPERHYDROCYClOPENTA-[C]-THI

View entire compound with spectra: 1 NMR

RAC-N(6)-BENZOYL-2',3',5'-TRIDEOXY-3',5'-(METHANOSULFONYLMETHANO)-1'-A-CARBAADENOSINE;N(6)-BENZOYL-9-(TRANS-2,2-DIOXOPERHYDROCYClOPENTA-[C]-THI
SpectraBase Compound ID 49nETU1KHRM
InChI InChI=1S/C20H21N5O3S/c26-20(13-4-2-1-3-5-13)24-18-17-19(22-11-21-18)25(12-23-17)16-8-14-6-7-29(27,28)10-15(14)9-16/h1-5,11-12,14-16H,6-10H2,(H,21,22,24,26)/t14-,15+,16+/m1/s1
InChIKey FFDYLCASGJCQRB-PMPSAXMXSA-N
Mol Weight 411.48 g/mol
Molecular Formula C20H21N5O3S
Exact Mass 411.136511 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CiJRIU2p79x
Name RAC-N(6)-BENZOYL-2',3',5'-TRIDEOXY-3',5'-(METHANOSULFONYLMETHANO)-1'-A-CARBAADENOSINE;N(6)-BENZOYL-9-(TRANS-2,2-DIOXOPERHYDROCYClOPENTA-[C]-THI
Compound Number 24
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H21N5O3S
InChI InChI=1S/C20H21N5O3S/c26-20(13-4-2-1-3-5-13)24-18-17-19(22-11-21-18)25(12-23-17)16-8-14-6-7-29(27,28)10-15(14)9-16/h1-5,11-12,14-16H,6-10H2,(H,21,22,24,26)/t14-,15+,16+/m1/s1
InChIKey FFDYLCASGJCQRB-PMPSAXMXSA-N
Literature Reference Author T.F.JENNY
Literature Reference Citation HELV.CHIM.ACTA,76,248(1993)
Literature Reference DOI 10.1002/hlca.19930760118
Molecular Weight 411.478 g/mol
Solvent CDCl3
Source File Reference UWCS21134