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methyl 2-({3-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]benzoyl}amino)benzoate
SpectraBase Compound ID LONI6Lm2f4r
InChI InChI=1S/C21H20ClN3O3/c1-13-19(22)14(2)25(24-13)12-15-7-6-8-16(11-15)20(26)23-18-10-5-4-9-17(18)21(27)28-3/h4-11H,12H2,1-3H3,(H,23,26)
InChIKey SNAHGXIIRCIAQJ-UHFFFAOYSA-N
Mol Weight 397.86 g/mol
Molecular Formula C21H20ClN3O3
Exact Mass 397.119319 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID H3peJtiWkUc
Name methyl 2-({3-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]benzoyl}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/C21H20ClN3O3/c1-13-19(22)14(2)25(24-13)12-15-7-6-8-16(11-15)20(26)23-18-10-5-4-9-17(18)21(27)28-3/h4-11H,12H2,1-3H3,(H,23,26)
InChIKey SNAHGXIIRCIAQJ-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_4228
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: 8018971; UBI_ID: UBI-004229
Temperature 313 °C