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2(1H)-pyrimidinone, 6-(3-ethoxy-4-hydroxyphenyl)tetrahydro-4-hydroxy-5-(4-methoxybenzoyl)-4-(trifluoromethyl)-
SpectraBase Compound ID Gsx3dt7vh2k
InChI InChI=1S/C21H21F3N2O6/c1-3-32-15-10-12(6-9-14(15)27)17-16(18(28)11-4-7-13(31-2)8-5-11)20(30,21(22,23)24)26-19(29)25-17/h4-10,16-17,27,30H,3H2,1-2H3,(H2,25,26,29)
InChIKey KGUWKAPJHDUIMD-UHFFFAOYSA-N
Mol Weight 454.4 g/mol
Molecular Formula C21H21F3N2O6
Exact Mass 454.135171 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DIwKEebINmH
Name 2(1H)-pyrimidinone, 6-(3-ethoxy-4-hydroxyphenyl)tetrahydro-4-hydroxy-5-(4-methoxybenzoyl)-4-(trifluoromethyl)-
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/C21H21F3N2O6/c1-3-32-15-10-12(6-9-14(15)27)17-16(18(28)11-4-7-13(31-2)8-5-11)20(30,21(22,23)24)26-19(29)25-17/h4-10,16-17,27,30H,3H2,1-2H3,(H2,25,26,29)
InChIKey KGUWKAPJHDUIMD-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_2883
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/11248428