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thiourea, N-[(1,2-dihydro-1-methyl-2-oxo-3-quinolinyl)methyl]-N-methyl-N'-[4-(trifluoromethyl)phenyl]-
SpectraBase Compound ID JW9qXTwSYBK
InChI InChI=1S/C20H18F3N3OS/c1-25(19(28)24-16-9-7-15(8-10-16)20(21,22)23)12-14-11-13-5-3-4-6-17(13)26(2)18(14)27/h3-11H,12H2,1-2H3,(H,24,28)
InChIKey HEQNZLRCLPWDJO-UHFFFAOYSA-N
Mol Weight 405.44 g/mol
Molecular Formula C20H18F3N3OS
Exact Mass 405.112268 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FudYG2LIeCI
Name thiourea, N-[(1,2-dihydro-1-methyl-2-oxo-3-quinolinyl)methyl]-N-methyl-N'-[4-(trifluoromethyl)phenyl]-
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/C20H18F3N3OS/c1-25(19(28)24-16-9-7-15(8-10-16)20(21,22)23)12-14-11-13-5-3-4-6-17(13)26(2)18(14)27/h3-11H,12H2,1-2H3,(H,24,28)
InChIKey HEQNZLRCLPWDJO-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_8184
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: F31725; Labnumber: NNA-V-18026