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6-({[(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)methyl]amino}carbonyl)-3-cyclohexene-1-carboxylic acid
SpectraBase Compound ID 2QLwfCVD4FG
InChI InChI=1S/C20H23N3O3/c1-13-18(14(2)23(22-13)15-8-4-3-5-9-15)12-21-19(24)16-10-6-7-11-17(16)20(25)26/h3-9,16-17H,10-12H2,1-2H3,(H,21,24)(H,25,26)
InChIKey CEVDAKZMDQZIES-UHFFFAOYSA-N
Mol Weight 353.42 g/mol
Molecular Formula C20H23N3O3
Exact Mass 353.173942 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FGo3cbgnkEd
Name 6-({[(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)methyl]amino}carbonyl)-3-cyclohexene-1-carboxylic acid
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/C20H23N3O3/c1-13-18(14(2)23(22-13)15-8-4-3-5-9-15)12-21-19(24)16-10-6-7-11-17(16)20(25)26/h3-9,16-17H,10-12H2,1-2H3,(H,21,24)(H,25,26)
InChIKey CEVDAKZMDQZIES-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_34683
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: 9148327; SBI_ID: SBI-034687
Temperature 318 °C