For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
5-((3-(4-bromophenyl)-1-phenyl-1H-pyrazol-4-yl)methylene)-3-(4-chlorophenyl)-2-thioxothiazolidin-4-one
SpectraBase Compound ID ASwsrUGnt2b
InChI InChI=1S/C25H15BrClN3OS2/c26-18-8-6-16(7-9-18)23-17(15-29(28-23)20-4-2-1-3-5-20)14-22-24(31)30(25(32)33-22)21-12-10-19(27)11-13-21/h1-15H
InChIKey WQYYTDRYHVCRIP-UHFFFAOYSA-N
Mol Weight 552.89 g/mol
Molecular Formula C25H15BrClN3OS2
Exact Mass 550.952845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 9jTSox6i4Ar
Name 5-((3-(4-bromophenyl)-1-phenyl-1H-pyrazol-4-yl)methylene)-3-(4-chlorophenyl)-2-thioxothiazolidin-4-one
Appearance Yellow crystalline solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H15BrClN3OS2
InChI InChI=1S/C25H15BrClN3OS2/c26-18-8-6-16(7-9-18)23-17(15-29(28-23)20-4-2-1-3-5-20)14-22-24(31)30(25(32)33-22)21-12-10-19(27)11-13-21/h1-15H
InChIKey WQYYTDRYHVCRIP-UHFFFAOYSA-N
Instrument Name Shimadzu QP2010
Ionization Type EI
Literature Reference DOI 10.1016/j.arabjc.2013.05.029
Molecular Weight 552.892 g/mol
SMILES C(c1c(n[n](c1)-c1ccccc1)-c1ccc(cc1)Br)=C1C(N(C(S1)=S)c1ccc(cc1)Cl)=O
SPLASH splash10-0fb9-0694020000-23c8cc6153d903d0a8dd
Source of Spectrum AJC-10-SM17-3f
Wiley ID 1857159