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(3R/S,2''R/S)-N-[3-[1-(THIOLAN-2-YL)-CYTOSIN-5-YL]-PROP-2-YN-1-YL]-OXOLANE-3-SULFONAMIDE
SpectraBase Compound ID 7gmarEGHVnu
InChI InChI=1S/C15H20N4O4S2/c16-14-11(9-19(15(20)18-14)13-4-2-8-24-13)3-1-6-17-25(21,22)12-5-7-23-10-12/h9,12-13,17H,2,4-8,10H2,(H2,16,18,20)
InChIKey NNYXGNOPPRLTJI-UHFFFAOYSA-N
Mol Weight 384.47 g/mol
Molecular Formula C15H20N4O4S2
Exact Mass 384.092597 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IYbHAABkQGq
Name (3R/S,2''R/S)-N-[3-[1-(THIOLAN-2-YL)-CYTOSIN-5-YL]-PROP-2-YN-1-YL]-OXOLANE-3-SULFONAMIDE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H20N4O4S2
InChI InChI=1S/C15H20N4O4S2/c16-14-11(9-19(15(20)18-14)13-4-2-8-24-13)3-1-6-17-25(21,22)12-5-7-23-10-12/h9,12-13,17H,2,4-8,10H2,(H2,16,18,20)
InChIKey NNYXGNOPPRLTJI-UHFFFAOYSA-N
Literature Reference Author A.P.SCHUETZ,S.LOCHER,B.BERNET,B.ILLARIONOV,M.FISCHER,A.BACHE R,F.DIEDERICH
Literature Reference Citation EUR.J.ORG.CHEM.,2013,880(2013)
Literature Reference DOI 10.1002/ejoc.201201454
Molecular Weight 384.468 g/mol
Solvent ACETONE-D6
Source File Reference UWBT17442