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(5S,8AS)-5-METHYL-4,6,7,8,8A,9-HEXAHYDROTHIENO-[3,2-F]-INDOLIZINIUM-IODIDE
SpectraBase Compound ID KsR5kM85Elv
InChI InChI=1S/C11H16NS.HI/c1-12-5-2-3-10(12)7-11-9(8-12)4-6-13-11;/h4,6,10H,2-3,5,7-8H2,1H3;1H/q+1;/p-1/t10-,12?;/m0./s1
InChIKey QWDHCXQDPZPPGR-JQQXDGTNSA-M
Mol Weight 321.22 g/mol
Molecular Formula C11H16INS
Exact Mass 321.004816 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Jo34JGZ19dq
Name (5S,8AS)-5-METHYL-4,6,7,8,8A,9-HEXAHYDROTHIENO-[3,2-F]-INDOLIZINIUM-IODIDE
Compound Number 20
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H16INS
InChI InChI=1S/C11H16NS.HI/c1-12-5-2-3-10(12)7-11-9(8-12)4-6-13-11;/h4,6,10H,2-3,5,7-8H2,1H3;1H/q+1;/p-1/t10-,12?;/m0./s1
InChIKey QWDHCXQDPZPPGR-JQQXDGTNSA-M
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 321.219 g/mol
Solvent CD3OD
Source File Reference UWLU83594