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(8AS,9S)-6-OXO-4,6,7,8,8A,9-HEXAHYDROTHIENO-[3,2-F]-INDOLIZIN-9-YL-ACETATE
SpectraBase Compound ID KcRKpOOXF0p
InChI InChI=1S/C12H13NO3S/c1-7(14)16-11-9-2-3-10(15)13(9)6-8-4-5-17-12(8)11/h4-5,9,11H,2-3,6H2,1H3/t9-,11-/m0/s1
InChIKey KLSHFQUDNJXCGB-ONGXEEELSA-N
Mol Weight 251.3 g/mol
Molecular Formula C12H13NO3S
Exact Mass 251.061614 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IVdSJlT92Ks
Name (8AS,9S)-6-OXO-4,6,7,8,8A,9-HEXAHYDROTHIENO-[3,2-F]-INDOLIZIN-9-YL-ACETATE
Compound Number 16
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H13NO3S
InChI InChI=1S/C12H13NO3S/c1-7(14)16-11-9-2-3-10(15)13(9)6-8-4-5-17-12(8)11/h4-5,9,11H,2-3,6H2,1H3/t9-,11-/m0/s1
InChIKey KLSHFQUDNJXCGB-ONGXEEELSA-N
Literature Reference Author P.SAFAR,J.ZUZIOVA,S.MARCHLIN,N.PRONAYOVA,L.SVORC,V.VRABEL,S. SESTAK,D.RENDIC,V.TO
Literature Reference Citation EUR.J.ORG.CHEM.,2012,5498(2012)
Literature Reference DOI 10.1002/ejoc.201200431
Molecular Weight 251.300 g/mol
Solvent CD3OD
Source File Reference UWLU83591