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5-[4-(4-Methyl-phenyl)-2-piperidino-thiazol-5-yl]-1,3,5-triphenyl-penta-2,4-diene-1-one
SpectraBase Compound ID KB5rv8bW3jj
InChI InChI=1S/C38H34N2OS/c1-28-20-22-32(23-21-28)36-37(42-38(39-36)40-24-12-5-13-25-40)34(30-16-8-3-9-17-30)26-33(29-14-6-2-7-15-29)27-35(41)31-18-10-4-11-19-31/h2-4,6-11,14-23,26-27H,5,12-13,24-25H2,1H3/b33-27+,34-26+
InChIKey AFZZPSOIOLYKIE-MJBJSEBZSA-N
Mol Weight 566.8 g/mol
Molecular Formula C38H34N2OS
Exact Mass 566.239185 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C4O0JB5UyLU
Name 5-[4-(4-Methyl-phenyl)-2-piperidino-thiazol-5-yl]-1,3,5-triphenyl-penta-2,4-diene-1-one
Alternate Name(s) (2E,4E)-1,3,5-triphenyl-5-(2-(piperidin-1-yl)-4-(p-tolyl)thiazol-5-yl)penta-2,4-dien-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C38H34N2OS
InChI InChI=1S/C38H34N2OS/c1-28-20-22-32(23-21-28)36-37(42-38(39-36)40-24-12-5-13-25-40)34(30-16-8-3-9-17-30)26-33(29-14-6-2-7-15-29)27-35(41)31-18-10-4-11-19-31/h2-4,6-11,14-23,26-27H,5,12-13,24-25H2,1H3/b33-27+,34-26+
InChIKey AFZZPSOIOLYKIE-MJBJSEBZSA-N
Literature Reference DOI 10.1002/prac.19893310519
Molecular Weight 566.763 g/mol
SMILES C(c1ccccc1)(\C=C\(c1ccccc1)\C=C/(c1ccccc1)c1c(nc(s1)N1CCCCC1)-c1ccc(cc1)C)=O
SPLASH splash10-08fr-5500920000-dda8bebac757eddb9e37
Source of Spectrum JF-331-849-8j
Wiley ID 1791765