4-((E)-{[3-(4-methylphenyl)-1-phenyl-1H-pyrazol-5-yl]imino}methyl)phenyl 4-methylbenzenesulfonate

SpectraBase Compound ID	LBAofLaUIOj
InChI	InChI=1S/C30H25N3O3S/c1-22-8-14-25(15-9-22)29-20-30(33(32-29)26-6-4-3-5-7-26)31-21-24-12-16-27(17-13-24)36-37(34,35)28-18-10-23(2)11-19-28/h3-21H,1-2H3/b31-21+
InChIKey	DGIGBXAONMNHQR-NJZRLIGZSA-N Google Search
Mol Weight	507.61 g/mol
Molecular Formula	C30H25N3O3S
Exact Mass	507.161663 g/mol

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SpectraBase Spectrum ID	ErY9bxf5TPE
Name	4-((E)-{[3-(4-methylphenyl)-1-phenyl-1H-pyrazol-5-yl]imino}methyl)phenyl 4-methylbenzenesulfonate
Author	A.V.Yarkov, IPAC, Russia
Copyright	Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI	InChI=1S/C30H25N3O3S/c1-22-8-14-25(15-9-22)29-20-30(33(32-29)26-6-4-3-5-7-26)31-21-24-12-16-27(17-13-24)36-37(34,35)28-18-10-23(2)11-19-28/h3-21H,1-2H3/b31-21+
InChIKey	DGIGBXAONMNHQR-NJZRLIGZSA-N
NMR Offset	15.0036
NMR Spectrometer Frequency	250.134
Observed nucleus	1H
Origin	1H_ASIOH_7000_3608
Owner	Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State	soluted
Solvent	DMSO-d6
Source File Reference	VendorID: ZI/6068044; Labnumber: LP-0900372; IOH_ID: IOH-003609
Synonyms	4-({[3-(4-methylphenyl)-1-phenyl-1H-pyrazol-5-yl]imino}methyl)phenyl 4-methylbenzenesulfonate
Temperature	297 °C