butyl 5-({(Z)-[1-(4-bromophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)-2-chlorobenzoate

SpectraBase Compound ID	95dBZ11a10s
InChI	InChI=1S/C22H21BrClN3O3/c1-3-4-11-30-22(29)18-12-16(7-10-20(18)24)25-13-19-14(2)26-27(21(19)28)17-8-5-15(23)6-9-17/h5-10,12-13,25H,3-4,11H2,1-2H3/b19-13-
InChIKey	ZIUITFCQIKSDKL-UYRXBGFRSA-N Google Search
Mol Weight	490.79 g/mol
Molecular Formula	C22H21BrClN3O3
Exact Mass	489.045482 g/mol

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SpectraBase Spectrum ID	2FxuaS6W2s9
Name	butyl 5-({(Z)-[1-(4-bromophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)-2-chlorobenzoate
Author	A.V.Yarkov, IPAC, Russia
Copyright	Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI	InChI=1S/C22H21BrClN3O3/c1-3-4-11-30-22(29)18-12-16(7-10-20(18)24)25-13-19-14(2)26-27(21(19)28)17-8-5-15(23)6-9-17/h5-10,12-13,25H,3-4,11H2,1-2H3/b19-13-
InChIKey	ZIUITFCQIKSDKL-UYRXBGFRSA-N
NMR Offset	15.3537
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UZI_26187_5177
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: UZI/8067304; Labnumber: BMW-98153T; UZI_ID: UZI-005179
Synonyms	butyl 5-({[1-(4-bromophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)-2-chlorobenzoate
Temperature	308 °C