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1-piperidinecarboxylic acid, 4-[1-(3,4-dimethylphenyl)-4-[[[3-(trifluoromethyl)phenyl]amino]carbonyl]-1H-pyrazol-5-yl]-, 1,1-dimethylethyl

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1-piperidinecarboxylic acid, 4-[1-(3,4-dimethylphenyl)-4-[[[3-(trifluoromethyl)phenyl]amino]carbonyl]-1H-pyrazol-5-yl]-, 1,1-dimethylethyl
SpectraBase Compound ID 99MDumvhPQ4
InChI InChI=1S/C29H33F3N4O3/c1-18-9-10-23(15-19(18)2)36-25(20-11-13-35(14-12-20)27(38)39-28(3,4)5)24(17-33-36)26(37)34-22-8-6-7-21(16-22)29(30,31)32/h6-10,15-17,20H,11-14H2,1-5H3,(H,34,37)
InChIKey GFSHNOUJJIHDPV-UHFFFAOYSA-N
Mol Weight 542.6 g/mol
Molecular Formula C29H33F3N4O3
Exact Mass 542.250475 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6GXuNbBq00D
Name 1-piperidinecarboxylic acid, 4-[1-(3,4-dimethylphenyl)-4-[[[3-(trifluoromethyl)phenyl]amino]carbonyl]-1H-pyrazol-5-yl]-, 1,1-dimethylethyl
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 542.250475425 u
Formula C29H33F3N4O3
InChI InChI=1S/C29H33F3N4O3/c1-18-9-10-23(15-19(18)2)36-25(20-11-13-35(14-12-20)27(38)39-28(3,4)5)24(17-33-36)26(37)34-22-8-6-7-21(16-22)29(30,31)32/h6-10,15-17,20H,11-14H2,1-5H3,(H,34,37)
InChIKey GFSHNOUJJIHDPV-UHFFFAOYSA-N
Molecular Weight 542.603 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_5301
Solvent DMSO-d6
Source Vendor ID: NMR/12708018