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4-(3-chloro-4-hydroxyphenyl)-6-methyl-2-oxo-N-[3-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydro-5-pyrimidinecarboxamide
SpectraBase Compound ID IoKSInC3SJO
InChI InChI=1S/C19H15ClF3N3O3/c1-9-15(17(28)25-12-4-2-3-11(8-12)19(21,22)23)16(26-18(29)24-9)10-5-6-14(27)13(20)7-10/h2-8,16,27H,1H3,(H,25,28)(H2,24,26,29)
InChIKey BGBMADNBTREPCM-UHFFFAOYSA-N
Mol Weight 425.8 g/mol
Molecular Formula C19H15ClF3N3O3
Exact Mass 425.075404 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 39G66L7xjwt
Name 4-(3-chloro-4-hydroxyphenyl)-6-methyl-2-oxo-N-[3-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydro-5-pyrimidinecarboxamide
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/C19H15ClF3N3O3/c1-9-15(17(28)25-12-4-2-3-11(8-12)19(21,22)23)16(26-18(29)24-9)10-5-6-14(27)13(20)7-10/h2-8,16,27H,1H3,(H,25,28)(H2,24,26,29)
InChIKey BGBMADNBTREPCM-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_31659
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: 1843174; SBI_ID: SBI-031663
Temperature 318 °C