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

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3-(4-Chloro-benzyl)-2-(4-chloro-phenylimino)-4-oxo-[1,3]thiazinane-6-carboxylic acid [4-(chloro-difluoro-methoxy)-phenyl]-amide
SpectraBase Compound ID JtPm1Gcuaah
InChI InChI=1S/C25H18Cl3F2N3O3S/c26-16-3-1-15(2-4-16)14-33-22(34)13-21(37-24(33)32-19-7-5-17(27)6-8-19)23(35)31-18-9-11-20(12-10-18)36-25(28,29)30/h1-12,21H,13-14H2,(H,31,35)/b32-24-
InChIKey RNVNMPYEMTUIRB-TZHWMEPESA-N
Mol Weight 584.85 g/mol
Molecular Formula C25H18Cl3F2N3O3S
Exact Mass 583.010252 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JiYV4ytws0
Name 2H-1,3-thiazine-6-carboxamide, N-[4-(chlorodifluoromethoxy)phenyl]-2-[(4-chlorophenyl)imino]-3-[(4-chlorophenyl)methyl]tetrahydro-4-oxo-, (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 583.010252049 u
Formula C25H18Cl3F2N3O3S
InChI InChI=1S/C25H18Cl3F2N3O3S/c26-16-3-1-15(2-4-16)14-33-22(34)13-21(37-24(33)32-19-7-5-17(27)6-8-19)23(35)31-18-9-11-20(12-10-18)36-25(28,29)30/h1-12,21H,13-14H2,(H,31,35)/b32-24-
InChIKey RNVNMPYEMTUIRB-TZHWMEPESA-N
Molecular Weight 584.853 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_14589
Solvent DMSO-d6
Source Vendor ID: NMR/10215663; Lab Info: PE; Lab Number: NMR/9296032