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4-(4-Chlorophenyl)diazenyl-5-methyl-1-(4-(pyridin-3-yl)thiazol-2-yl)pyrazolidin-3-one
SpectraBase Compound ID 8OWHCe1R932
InChI InChI=1S/C18H15ClN6OS/c1-11-16(23-22-14-6-4-13(19)5-7-14)17(26)24-25(11)18-21-15(10-27-18)12-3-2-8-20-9-12/h2-11,16H,1H3,(H,24,26)
InChIKey VTZKEXGBYMLSJD-UHFFFAOYSA-N
Mol Weight 398.87 g/mol
Molecular Formula C18H15ClN6OS
Exact Mass 398.071658 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LXrW0EhC6cg
Name 4-(4-Chlorophenyl)diazenyl-5-methyl-1-(4-(pyridin-3-yl)thiazol-2-yl)pyrazolidin-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H15ClN6OS
InChI InChI=1S/C18H15ClN6OS/c1-11-16(23-22-14-6-4-13(19)5-7-14)17(26)24-25(11)18-21-15(10-27-18)12-3-2-8-20-9-12/h2-11,16H,1H3,(H,24,26)
InChIKey VTZKEXGBYMLSJD-UHFFFAOYSA-N
Instrument Name Finnigan MAT 8222 EX
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2671
Molecular Weight 398.872 g/mol
SMILES N1N(C(C(C1=O)N=Nc1ccc(cc1)Cl)C)c1nc(cs1)-c1cnccc1
SPLASH splash10-03ds-3489000000-248a0c26d59f6108d3d1
Source of Spectrum Y-54-1041-12b
Wiley ID 1878033