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(+/-)-N-[3-[1-(THIOLAN-2-YL)-CYTOSIN-5-YL]-PROP-2-YN-1-YL]-VINYLSULFONAMIDE
SpectraBase Compound ID Gxr55jYqxD5
InChI InChI=1S/C13H16N4O3S2/c1-2-22(19,20)15-7-3-5-10-9-17(11-6-4-8-21-11)13(18)16-12(10)14/h2,9,11,15H,1,4,6-8H2,(H2,14,16,18)
InChIKey SYMNKDMRKWYEOF-UHFFFAOYSA-N
Mol Weight 340.42 g/mol
Molecular Formula C13H16N4O3S2
Exact Mass 340.066383 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9oZ8uOY6SrV
Name (+/-)-N-[3-[1-(THIOLAN-2-YL)-CYTOSIN-5-YL]-PROP-2-YN-1-YL]-VINYLSULFONAMIDE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H16N4O3S2
InChI InChI=1S/C13H16N4O3S2/c1-2-22(19,20)15-7-3-5-10-9-17(11-6-4-8-21-11)13(18)16-12(10)14/h2,9,11,15H,1,4,6-8H2,(H2,14,16,18)
InChIKey SYMNKDMRKWYEOF-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 340.415 g/mol
Solvent ACETONE-D6
Source File Reference UWBT17439