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3-({[(1,3-diphenyl-1H-pyrazol-4-yl)methyl]amino}carbonyl)-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid
SpectraBase Compound ID Chj67DHgnMy
InChI InChI=1S/C24H23N3O4/c28-23(20-18-11-12-19(31-18)21(20)24(29)30)25-13-16-14-27(17-9-5-2-6-10-17)26-22(16)15-7-3-1-4-8-15/h1-10,14,18-21H,11-13H2,(H,25,28)(H,29,30)/t18-,19+,20+,21+/m0/s1
InChIKey KTTCTGOIGNNNMJ-DOIPELPJSA-N
Mol Weight 417.47 g/mol
Molecular Formula C24H23N3O4
Exact Mass 417.168856 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4fjmc4Djfoh
Name 3-({[(1,3-diphenyl-1H-pyrazol-4-yl)methyl]amino}carbonyl)-7-oxabicyclo[2.2.1]heptane-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/C24H23N3O4/c28-23(20-18-11-12-19(31-18)21(20)24(29)30)25-13-16-14-27(17-9-5-2-6-10-17)26-22(16)15-7-3-1-4-8-15/h1-10,14,18-21H,11-13H2,(H,25,28)(H,29,30)/t18-,19+,20+,21+/m0/s1
InChIKey KTTCTGOIGNNNMJ-DOIPELPJSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_4296
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: UZI/9159968; Labnumber: BAM_UACK/008274; UZI_ID: UZI-004298
Temperature 318 °C