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4a,7-dihydro-4a,6,8-trimethyl-7-oxo-2-phenyl-4H-cyclopenta[b]thieno[2,3-e]pyridine-3-carbonitrile
SpectraBase Compound ID Cq5Qdm6nAZT
InChI InChI=1S/C20H16N2OS/c1-11-9-20(3)15(17(11)23)12(2)18-16(22-20)14(10-21)19(24-18)13-7-5-4-6-8-13/h4-9,22H,1-3H3
InChIKey XWZYCIGFLALMSO-UHFFFAOYSA-N
Mol Weight 332.42 g/mol
Molecular Formula C20H16N2OS
Exact Mass 332.098334 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GoEVOqrxXoJ
Name 4A,7-DIHYDRO-4A,6,8-TRIMETHYL-7-OXO-2-PHENYL-4H-CYCLOPENTA-[B]-THIENO-[2,3-E]-PYRIDINE-3-CARBONITRILE
CAS Registry Number 118538-95-7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H16N2OS
InChI InChI=1S/C20H16N2OS/c1-11-9-20(3)15(17(11)23)12(2)18-16(22-20)14(10-21)19(24-18)13-7-5-4-6-8-13/h4-9,22H,1-3H3
InChIKey XWZYCIGFLALMSO-UHFFFAOYSA-N
Literature Reference Author K.HARTKE,W.F.RICHTER,W.MASSA,G.BAUM
Literature Reference Citation CHEM.BER.,122,657(1989)
Literature Reference DOI 10.1002/cber.19891220412
Molecular Weight 332.420 g/mol
Solvent CDCl3
Source File Reference UWGB1534