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7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 5,6-dihydro-5-imino-6-[[3-methoxy-4-[2-(4-methoxyphenoxy)ethoxy]phenyl]methylene]-2-(trifluoromethyl)-, (6Z)-
SpectraBase Compound ID 55cNkahzzHH
InChI InChI=1S/C23H19F3N4O5S/c1-32-14-4-6-15(7-5-14)34-9-10-35-17-8-3-13(12-18(17)33-2)11-16-19(27)30-22(28-20(16)31)36-21(29-30)23(24,25)26/h3-8,11-12,27H,9-10H2,1-2H3/b16-11-,27-19?
InChIKey VHLPDPVJFCWVES-SBXLSMMXSA-N
Mol Weight 520.48 g/mol
Molecular Formula C23H19F3N4O5S
Exact Mass 520.102825 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5dxUH49Ee4p
Name 7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 5,6-dihydro-5-imino-6-[[3-methoxy-4-[2-(4-methoxyphenoxy)ethoxy]phenyl]methylene]-2-(trifluoromethyl)-, (6Z)-
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/C23H19F3N4O5S/c1-32-14-4-6-15(7-5-14)34-9-10-35-17-8-3-13(12-18(17)33-2)11-16-19(27)30-22(28-20(16)31)36-21(29-30)23(24,25)26/h3-8,11-12,27H,9-10H2,1-2H3/b16-11-,27-19?
InChIKey VHLPDPVJFCWVES-SBXLSMMXSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_2634
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/11269314