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ETHYL_2-(4-CHLOROPHENYL)-METHYLIDENE-3-OXO-5-PHENYLCARBONYL-2,3-DIHYDROPYRROLO-[2.1-B]-THIAZOLE-7-CARBOXYLATE
SpectraBase Compound ID JpZgOvzKPEP
InChI InChI=1S/C23H16ClNO4S/c1-2-29-23(28)17-13-18(20(26)15-6-4-3-5-7-15)25-21(27)19(30-22(17)25)12-14-8-10-16(24)11-9-14/h3-13H,2H2,1H3/b19-12-
InChIKey BMQAALMMSSPMJK-UNOMPAQXSA-N
Mol Weight 437.9 g/mol
Molecular Formula C23H16ClNO4S
Exact Mass 437.048857 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KBCpTF3nz5r
Name ETHYL_2-(4-CHLOROPHENYL)-METHYLIDENE-3-OXO-5-PHENYLCARBONYL-2,3-DIHYDROPYRROLO-[2.1-B]-THIAZOLE-7-CARBOXYLATE
Compound Number 23
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H16ClNO4S
InChI InChI=1S/C23H16ClNO4S/c1-2-29-23(28)17-13-18(20(26)15-6-4-3-5-7-15)25-21(27)19(30-22(17)25)12-14-8-10-16(24)11-9-14/h3-13H,2H2,1H3/b19-12-
InChIKey BMQAALMMSSPMJK-UNOMPAQXSA-N
Literature Reference Author A.V.TVERDOKHLEBOV,A.P.ANDRUSHKO,A.A.TOLMACHEV,A.N.KOSTYUK,A. N.CHERNEGA,E.B.RUSAN
Literature Reference Citation MH.CHEM.,136,1781(2005)
Literature Reference DOI 10.1007/s00706-005-0356-1
Molecular Weight 437.897 g/mol
Solvent DMSO-D6
Source File Reference UWMZ18838