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3-({[3,5-dimethyl-1-(3-phenoxybenzyl)-1H-pyrazol-4-yl]amino}carbonyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
SpectraBase Compound ID FwmtVxUSKLm
InChI InChI=1S/C27H27N3O4/c1-16-25(28-26(31)23-19-11-12-20(14-19)24(23)27(32)33)17(2)30(29-16)15-18-7-6-10-22(13-18)34-21-8-4-3-5-9-21/h3-13,19-20,23-24H,14-15H2,1-2H3,(H,28,31)(H,32,33)
InChIKey TWCJORORZJHYNN-UHFFFAOYSA-N
Mol Weight 457.53 g/mol
Molecular Formula C27H27N3O4
Exact Mass 457.200156 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6XnZc4IUpgv
Name 3-({[3,5-dimethyl-1-(3-phenoxybenzyl)-1H-pyrazol-4-yl]amino}carbonyl)bicyclo[2.2.1]hept-5-ene-2-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/C27H27N3O4/c1-16-25(28-26(31)23-19-11-12-20(14-19)24(23)27(32)33)17(2)30(29-16)15-18-7-6-10-22(13-18)34-21-8-4-3-5-9-21/h3-13,19-20,23-24H,14-15H2,1-2H3,(H,28,31)(H,32,33)
InChIKey TWCJORORZJHYNN-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_33464
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: 1927500; SBI_ID: SBI-033468
Temperature 318 °C