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3-[2-(4-chloro-phenyl)-ethyl]-4-oxo-2-phenylimino-[1,3]thiazinane-6-carboxylic acid [4-(chloro-difluoro-methoxy)-phenyl]-amide

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3-[2-(4-chloro-phenyl)-ethyl]-4-oxo-2-phenylimino-[1,3]thiazinane-6-carboxylic acid [4-(chloro-difluoro-methoxy)-phenyl]-amide
SpectraBase Compound ID IFJTctV0TPy
InChI InChI=1S/C26H21Cl2F2N3O3S/c27-18-8-6-17(7-9-18)14-15-33-23(34)16-22(37-25(33)32-19-4-2-1-3-5-19)24(35)31-20-10-12-21(13-11-20)36-26(28,29)30/h1-13,22H,14-16H2,(H,31,35)/b32-25-
InChIKey IGKNWNOTPATKLL-MKCFTUBBSA-N
Mol Weight 564.43 g/mol
Molecular Formula C26H21Cl2F2N3O3S
Exact Mass 563.064874 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AaMoVQXbVVE
Name 2H-1,3-thiazine-6-carboxamide, N-[4-(chlorodifluoromethoxy)phenyl]-3-[2-(4-chlorophenyl)ethyl]tetrahydro-4-oxo-2-(phenylimino)-, (2Z)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 563.064874445 u
Formula C26H21Cl2F2N3O3S
InChI InChI=1S/C26H21Cl2F2N3O3S/c27-18-8-6-17(7-9-18)14-15-33-23(34)16-22(37-25(33)32-19-4-2-1-3-5-19)24(35)31-20-10-12-21(13-11-20)36-26(28,29)30/h1-13,22H,14-16H2,(H,31,35)/b32-25-
InChIKey IGKNWNOTPATKLL-MKCFTUBBSA-N
Molecular Weight 564.435 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_14590
Solvent DMSO-d6
Source Vendor ID: NMR/10215667; Lab Info: PE; Lab Number: NMR/9296037