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2-chloro-5-(5-hydroxy-3-methyl-3'-phenyl-1H,1'H-[4,4'-bipyrazol]-1-yl)benzoic acid
SpectraBase Compound ID JkuUIvBH50v
InChI InChI=1S/C20H15ClN4O3/c1-11-17(15-10-22-23-18(15)12-5-3-2-4-6-12)19(26)25(24-11)13-7-8-16(21)14(9-13)20(27)28/h2-10,26H,1H3,(H,22,23)(H,27,28)
InChIKey WLNYGCUIZNHFNM-UHFFFAOYSA-N
Mol Weight 394.82 g/mol
Molecular Formula C20H15ClN4O3
Exact Mass 394.083268 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EdabU18veQt
Name 2-chloro-5-(5-hydroxy-3-methyl-3'-phenyl-1H,1'H-[4,4'-bipyrazol]-1-yl)benzoic 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/C20H15ClN4O3/c1-11-17(15-10-22-23-18(15)12-5-3-2-4-6-12)19(26)25(24-11)13-7-8-16(21)14(9-13)20(27)28/h2-10,26H,1H3,(H,22,23)(H,27,28)
InChIKey WLNYGCUIZNHFNM-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_1238
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: NMR/11229133