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3-Benzyl-2-({4-[chloro(difluoro)methoxy]phenyl}imino)-N-(2-chlorophenyl)-4-oxo-1,3-thiazinane-6-carboxamide
SpectraBase Compound ID 9ELjbTHkoET
InChI InChI=1S/C25H19Cl2F2N3O3S/c26-19-8-4-5-9-20(19)31-23(34)21-14-22(33)32(15-16-6-2-1-3-7-16)24(36-21)30-17-10-12-18(13-11-17)35-25(27,28)29/h1-13,21H,14-15H2,(H,31,34)/b30-24-
InChIKey DNUOHZDKCPYLDL-KRUMMXJUSA-N
Mol Weight 550.41 g/mol
Molecular Formula C25H19Cl2F2N3O3S
Exact Mass 549.049224 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LotSJUak37w
Name 2H-1,3-thiazine-6-carboxamide, 2-[[4-(chlorodifluoromethoxy)phenyl]imino]-N-(2-chlorophenyl)tetrahydro-4-oxo-3-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 549.049224381 u
Formula C25H19Cl2F2N3O3S
InChI InChI=1S/C25H19Cl2F2N3O3S/c26-19-8-4-5-9-20(19)31-23(34)21-14-22(33)32(15-16-6-2-1-3-7-16)24(36-21)30-17-10-12-18(13-11-17)35-25(27,28)29/h1-13,21H,14-15H2,(H,31,34)/b30-24-
InChIKey DNUOHZDKCPYLDL-KRUMMXJUSA-N
Molecular Weight 550.408 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_12923
Solvent DMSO-d6
Source Vendor ID: NMR/10215669; Lab Info: PE; Lab Number: NMR/9296039