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2H-1,3-thiazine-6-carboxylic acid, 2-[(3,4-difluorophenyl)imino]-3,4-dihydro-4-oxo-3-(2-phenylethyl)-, methyl ester, (2Z)-

View entire compound with spectra: 1 NMR

2H-1,3-thiazine-6-carboxylic acid, 2-[(3,4-difluorophenyl)imino]-3,4-dihydro-4-oxo-3-(2-phenylethyl)-, methyl ester, (2Z)-
SpectraBase Compound ID FiACBMwkUSZ
InChI InChI=1S/C20H16F2N2O3S/c1-27-19(26)17-12-18(25)24(10-9-13-5-3-2-4-6-13)20(28-17)23-14-7-8-15(21)16(22)11-14/h2-8,11-12H,9-10H2,1H3/b23-20-
InChIKey TXWFFQDYQNXAGC-ATJXCDBQSA-N
Mol Weight 402.42 g/mol
Molecular Formula C20H16F2N2O3S
Exact Mass 402.08497 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 24EBfS5Bilf
Name 2H-1,3-thiazine-6-carboxylic acid, 2-[(3,4-difluorophenyl)imino]-3,4-dihydro-4-oxo-3-(2-phenylethyl)-, methyl ester, (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 402.084969880 u
Formula C20H16F2N2O3S
InChI InChI=1S/C20H16F2N2O3S/c1-27-19(26)17-12-18(25)24(10-9-13-5-3-2-4-6-13)20(28-17)23-14-7-8-15(21)16(22)11-14/h2-8,11-12H,9-10H2,1H3/b23-20-
InChIKey TXWFFQDYQNXAGC-ATJXCDBQSA-N
Molecular Weight 402.416 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_5537
Solvent DMSO-d6
Source Vendor ID: NMR/13288883