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6-CYANO-3-ETHYL-4,5-BIS-(METHOXYCARBONYL)-1,2-DIHYDRO-4H-3-THIONIA-BENZOCYClOOCTEN-4-IDE
SpectraBase Compound ID KaY0ZiltRuB
InChI InChI=1S/C18H20NO4S/c1-4-24-10-9-12-7-5-6-8-13(12)14(11-19)15(17(20)22-2)16(24)18(21)23-3/h5-8,16H,4,9-10H2,1-3H3/b15-14+
InChIKey KYGPEOHAAWFDLZ-CCEZHUSRSA-N
Mol Weight 346.42 g/mol
Molecular Formula C18H20NO4S
Exact Mass 346.111304 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GJLvbuynq5u
Name 6-CYANO-3-ETHYL-4,5-BIS-(METHOXYCARBONYL)-1,2-DIHYDRO-4H-3-THIONIA-BENZOCYClOOCTEN-4-IDE
Compound Number 32C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H20NO4S
InChI InChI=1S/C18H20NO4S/c1-4-24-10-9-12-7-5-6-8-13(12)14(11-19)15(17(20)22-2)16(24)18(21)23-3/h5-8,16H,4,9-10H2,1-3H3/b15-14+
InChIKey KYGPEOHAAWFDLZ-CCEZHUSRSA-N
Literature Reference Author T.KATAOKA,M.KATAOKA,M.IKEMORI,H.SHIMIZU,M.HORI,I.MIURA
Literature Reference Citation J.CHEM.SOC.PERKIN-1,1973(1993)
Literature Reference DOI 10.1039/p19930001973
Molecular Weight 346.421 g/mol
Solvent CDCl3
Source File Reference UWCP1447