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2-CHLORO-7-(TERT.-BUTYL)-4,7-DIHYDRO-4-OXOTHIENO-[2.3-B]-PYRIDINE-5-CARBOXYLATE
SpectraBase Compound ID IefHwxGnD55
InChI InChI=1S/C12H12ClNO3S/c1-12(2,3)14-5-7(11(16)17)9(15)6-4-8(13)18-10(6)14/h4-5H,1-3H3,(H,16,17)
InChIKey BMHMZYYSGXLHOZ-UHFFFAOYSA-N
Mol Weight 285.75 g/mol
Molecular Formula C12H12ClNO3S
Exact Mass 285.022642 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FjvZ8TV6OrH
Name 2-CHLORO-7-(TERT.-BUTYL)-4,7-DIHYDRO-4-OXOTHIENO-[2.3-B]-PYRIDINE-5-CARBOXYLATE
Compound Number 7E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H12ClNO3S
InChI InChI=1S/C12H12ClNO3S/c1-12(2,3)14-5-7(11(16)17)9(15)6-4-8(13)18-10(6)14/h4-5H,1-3H3,(H,16,17)
InChIKey BMHMZYYSGXLHOZ-UHFFFAOYSA-N
Literature Reference Author M.M.EL-ABADELAH,S.S.SABRI,H.A.AL-ASHQAR
Literature Reference Citation HETEROCYCLES,45,255(1997)
Literature Reference DOI 10.3987/COM-96-7613
Molecular Weight 285.745 g/mol
Solvent CDCl3
Source File Reference UWMZ2065