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1,3-benzenediol, 4-[4-(4-methoxyphenyl)-3-(trifluoromethyl)-5-isoxazolyl]-
SpectraBase Compound ID KOqHKTtVRIN
InChI InChI=1S/C17H12F3NO4/c1-24-11-5-2-9(3-6-11)14-15(25-21-16(14)17(18,19)20)12-7-4-10(22)8-13(12)23/h2-8,22-23H,1H3
InChIKey ZSQOMHMGCYTQAQ-UHFFFAOYSA-N
Mol Weight 351.28 g/mol
Molecular Formula C17H12F3NO4
Exact Mass 351.071842 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7lEpe97w8E1
Name 1,3-benzenediol, 4-[4-(4-methoxyphenyl)-3-(trifluoromethyl)-5-isoxazolyl]-
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/C17H12F3NO4/c1-24-11-5-2-9(3-6-11)14-15(25-21-16(14)17(18,19)20)12-7-4-10(22)8-13(12)23/h2-8,22-23H,1H3
InChIKey ZSQOMHMGCYTQAQ-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_6794
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/18251565; Labnumber: 2504107