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(2Z)-2-[(4-chlorophenyl)imino]-N-(4-fluorophenyl)-3-(4-methoxybenzyl)-4-oxotetrahydro-2H-1,3-thiazine-6-carboxamide
SpectraBase Compound ID 9q1LJAuVYpL
InChI InChI=1S/C25H21ClFN3O3S/c1-33-21-12-2-16(3-13-21)15-30-23(31)14-22(24(32)28-19-10-6-18(27)7-11-19)34-25(30)29-20-8-4-17(26)5-9-20/h2-13,22H,14-15H2,1H3,(H,28,32)/b29-25-
InChIKey BPCQUBJBZUHKFD-GNVQSUKOSA-N
Mol Weight 497.97 g/mol
Molecular Formula C25H21ClFN3O3S
Exact Mass 497.097619 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BakuxuRSTym
Name 2H-1,3-thiazine-6-carboxamide, 2-[(4-chlorophenyl)imino]-N-(4-fluorophenyl)tetrahydro-3-[(4-methoxyphenyl)methyl]-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 497.097618582 u
Formula C25H21ClFN3O3S
InChI InChI=1S/C25H21ClFN3O3S/c1-33-21-12-2-16(3-13-21)15-30-23(31)14-22(24(32)28-19-10-6-18(27)7-11-19)34-25(30)29-20-8-4-17(26)5-9-20/h2-13,22H,14-15H2,1H3,(H,28,32)/b29-25-
InChIKey BPCQUBJBZUHKFD-GNVQSUKOSA-N
Molecular Weight 497.972 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_13287
Solvent DMSO-d6
Source Vendor ID: NMR/10215544; Lab Info: PE; Lab Number: NMR/8316438