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2H-1,3-thiazine-6-carboxamide, 3-(1,3-benzodioxol-5-ylmethyl)tetrahydro-4-oxo-2-(phenylimino)-N-[4-(trifluoromethoxy)phenyl]-, (2Z)-

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2H-1,3-thiazine-6-carboxamide, 3-(1,3-benzodioxol-5-ylmethyl)tetrahydro-4-oxo-2-(phenylimino)-N-[4-(trifluoromethoxy)phenyl]-, (2Z)-
SpectraBase Compound ID AEDp02JY2bN
InChI InChI=1S/C26H20F3N3O5S/c27-26(28,29)37-19-9-7-18(8-10-19)30-24(34)22-13-23(33)32(25(38-22)31-17-4-2-1-3-5-17)14-16-6-11-20-21(12-16)36-15-35-20/h1-12,22H,13-15H2,(H,30,34)/b31-25-
InChIKey OKQOGZRLPBGBDN-GDWJVWIDSA-N
Mol Weight 543.52 g/mol
Molecular Formula C26H20F3N3O5S
Exact Mass 543.107576 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3bRFmK8H9QM
Name 2H-1,3-thiazine-6-carboxamide, 3-(1,3-benzodioxol-5-ylmethyl)tetrahydro-4-oxo-2-(phenylimino)-N-[4-(trifluoromethoxy)phenyl]-, (2Z)-
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/C26H20F3N3O5S/c27-26(28,29)37-19-9-7-18(8-10-19)30-24(34)22-13-23(33)32(25(38-22)31-17-4-2-1-3-5-17)14-16-6-11-20-21(12-16)36-15-35-20/h1-12,22H,13-15H2,(H,30,34)/b31-25-
InChIKey OKQOGZRLPBGBDN-GDWJVWIDSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_3157
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/11278797