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3-({[1-(2-methylbenzyl)-1H-pyrazol-3-yl]amino}carbonyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
SpectraBase Compound ID C68kVj6BCOF
InChI InChI=1S/C20H21N3O3/c1-12-4-2-3-5-15(12)11-23-9-8-16(22-23)21-19(24)17-13-6-7-14(10-13)18(17)20(25)26/h2-9,13-14,17-18H,10-11H2,1H3,(H,25,26)(H,21,22,24)
InChIKey CDDMGOFJLGDXKI-UHFFFAOYSA-N
Mol Weight 351.41 g/mol
Molecular Formula C20H21N3O3
Exact Mass 351.158292 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CE1rcZKWFc
Name 3-({[1-(2-methylbenzyl)-1H-pyrazol-3-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/C20H21N3O3/c1-12-4-2-3-5-15(12)11-23-9-8-16(22-23)21-19(24)17-13-6-7-14(10-13)18(17)20(25)26/h2-9,13-14,17-18H,10-11H2,1H3,(H,25,26)(H,21,22,24)
InChIKey CDDMGOFJLGDXKI-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_33258
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: 1912292; SBI_ID: SBI-033262
Temperature 318 °C