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2-[5-(4-HYDROXY-3-METHOXYBENZYLIDENE)-4-OXO-3-PHENYL-THIAZOLIDIN-2-YLIDENE]-3-OXO-3-PIPERIDIN-1-YL-PROPIONITRILE
SpectraBase Compound ID CvBYqMa04Dn
InChI InChI=1S/C25H23N3O4S/c1-32-21-14-17(10-11-20(21)29)15-22-24(31)28(18-8-4-2-5-9-18)25(33-22)19(16-26)23(30)27-12-6-3-7-13-27/h2,4-5,8-11,14-15,29H,3,6-7,12-13H2,1H3/b22-15-,25-19-
InChIKey KVEVFLNEEZCBKS-MZGRUVDNSA-N
Mol Weight 461.54 g/mol
Molecular Formula C25H23N3O4S
Exact Mass 461.140927 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Emh1wvAN5VW
Name 2-[5-(4-HYDROXY-3-METHOXYBENZYLIDENE)-4-OXO-3-PHENYL-THIAZOLIDIN-2-YLIDENE]-3-OXO-3-PIPERIDIN-1-YL-PROPIONITRILE
Compound Number 4J
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H23N3O4S
InChI InChI=1S/C25H23N3O4S/c1-32-21-14-17(10-11-20(21)29)15-22-24(31)28(18-8-4-2-5-9-18)25(33-22)19(16-26)23(30)27-12-6-3-7-13-27/h2,4-5,8-11,14-15,29H,3,6-7,12-13H2,1H3/b22-15-,25-19-
InChIKey KVEVFLNEEZCBKS-MZGRUVDNSA-N
Literature Reference Author M.M.HANNA,R.F.GEORGE
Literature Reference Citation CHEM.PHARM.BULL.,60,1195(2012)
Literature Reference DOI 10.1248/cpb.c12-00498
Molecular Weight 461.535 g/mol
Source File Reference UWBT4728