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2H-1,3-thiazine-6-carboxamide, N-[4-(chlorodifluoromethoxy)phenyl]-2-[(4-fluorophenyl)imino]tetrahydro-3-methyl-4-oxo-, (2E)-
SpectraBase Compound ID APG8bPIuTRk
InChI InChI=1S/C19H15ClF3N3O3S/c1-26-16(27)10-15(30-18(26)25-13-4-2-11(21)3-5-13)17(28)24-12-6-8-14(9-7-12)29-19(20,22)23/h2-9,15H,10H2,1H3,(H,24,28)/b25-18+
InChIKey BLWBGMVGJHDPLN-XIEYBQDHSA-N
Mol Weight 457.86 g/mol
Molecular Formula C19H15ClF3N3O3S
Exact Mass 457.047475 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6yJLnISzvgd
Name 2H-1,3-thiazine-6-carboxamide, N-[4-(chlorodifluoromethoxy)phenyl]-2-[(4-fluorophenyl)imino]tetrahydro-3-methyl-4-oxo-, (2E)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 457.047474715 u
Formula C19H15ClF3N3O3S
InChI InChI=1S/C19H15ClF3N3O3S/c1-26-16(27)10-15(30-18(26)25-13-4-2-11(21)3-5-13)17(28)24-12-6-8-14(9-7-12)29-19(20,22)23/h2-9,15H,10H2,1H3,(H,24,28)/b25-18+
InChIKey BLWBGMVGJHDPLN-XIEYBQDHSA-N
Molecular Weight 457.855 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_14429
Solvent DMSO-d6
Source Vendor ID: NMR/10215656; Lab Info: PE; Lab Number: NMR/9296021