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2H-1,3-thiazine-6-carboxamide, N-[4-(chlorodifluoromethoxy)phenyl]-3-[2-(4-chlorophenyl)ethyl]tetrahydro-4-oxo-2-[[3-(trifluoromethyl)phenyl]imino]-,
SpectraBase Compound ID 85rYAKpGr37
InChI InChI=1S/C27H20Cl2F5N3O3S/c28-18-6-4-16(5-7-18)12-13-37-23(38)15-22(24(39)35-19-8-10-21(11-9-19)40-27(29,33)34)41-25(37)36-20-3-1-2-17(14-20)26(30,31)32/h1-11,14,22H,12-13,15H2,(H,35,39)/b36-25-
InChIKey UIFVSWMCHRPZCR-LAKKEJQSSA-N
Mol Weight 632.43 g/mol
Molecular Formula C27H20Cl2F5N3O3S
Exact Mass 631.052259 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Gf72Xbzdn7s
Name 2H-1,3-thiazine-6-carboxamide, N-[4-(chlorodifluoromethoxy)phenyl]-3-[2-(4-chlorophenyl)ethyl]tetrahydro-4-oxo-2-[[3-(trifluoromethyl)phenyl]imino]-,
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 631.052258902 u
Formula C27H20Cl2F5N3O3S
InChI InChI=1S/C27H20Cl2F5N3O3S/c28-18-6-4-16(5-7-18)12-13-37-23(38)15-22(24(39)35-19-8-10-21(11-9-19)40-27(29,33)34)41-25(37)36-20-3-1-2-17(14-20)26(30,31)32/h1-11,14,22H,12-13,15H2,(H,35,39)/b36-25-
InChIKey UIFVSWMCHRPZCR-LAKKEJQSSA-N
Molecular Weight 632.433 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_17657
Solvent DMSO-d6
Source Vendor ID: NMR/10215670; Lab Info: PE; Lab Number: NMR/9296040