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butyl 2-chloro-5-({(Z)-[3-methyl-1-(4-methylphenyl)-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)benzoate
SpectraBase Compound ID 7nSnnUNOX3M
InChI InChI=1S/C23H24ClN3O3/c1-4-5-12-30-23(29)19-13-17(8-11-21(19)24)25-14-20-16(3)26-27(22(20)28)18-9-6-15(2)7-10-18/h6-11,13-14,25H,4-5,12H2,1-3H3/b20-14-
InChIKey CAUWCQDDWTUZEM-ZHZULCJRSA-N
Mol Weight 425.92 g/mol
Molecular Formula C23H24ClN3O3
Exact Mass 425.150619 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4NflB4eueSH
Name butyl 2-chloro-5-({(Z)-[3-methyl-1-(4-methylphenyl)-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)benzoate
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/C23H24ClN3O3/c1-4-5-12-30-23(29)19-13-17(8-11-21(19)24)25-14-20-16(3)26-27(22(20)28)18-9-6-15(2)7-10-18/h6-11,13-14,25H,4-5,12H2,1-3H3/b20-14-
InChIKey CAUWCQDDWTUZEM-ZHZULCJRSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_2899
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/8070224; UBI_ID: UBI-002900
Synonyms butyl 2-chloro-5-({[3-methyl-1-(4-methylphenyl)-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)benzoate
Temperature 308 °C