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2H-1,3-thiazine-6-carboxamide, 3-(1,3-benzodioxol-5-ylmethyl)-2-[(4-fluorophenyl)imino]tetrahydro-4-oxo-N-phenyl-, (2E)-
SpectraBase Compound ID EVYyBZpfAAi
InChI InChI=1S/C25H20FN3O4S/c26-17-7-9-19(10-8-17)28-25-29(14-16-6-11-20-21(12-16)33-15-32-20)23(30)13-22(34-25)24(31)27-18-4-2-1-3-5-18/h1-12,22H,13-15H2,(H,27,31)/b28-25+
InChIKey OSCLIWCDRQTTCA-AZPGRJICSA-N
Mol Weight 477.51 g/mol
Molecular Formula C25H20FN3O4S
Exact Mass 477.115855 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 99X4Cj6ERyp
Name 2H-1,3-thiazine-6-carboxamide, 3-(1,3-benzodioxol-5-ylmethyl)-2-[(4-fluorophenyl)imino]tetrahydro-4-oxo-N-phenyl-, (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 477.115855469 u
Formula C25H20FN3O4S
InChI InChI=1S/C25H20FN3O4S/c26-17-7-9-19(10-8-17)28-25-29(14-16-6-11-20-21(12-16)33-15-32-20)23(30)13-22(34-25)24(31)27-18-4-2-1-3-5-18/h1-12,22H,13-15H2,(H,27,31)/b28-25+
InChIKey OSCLIWCDRQTTCA-AZPGRJICSA-N
Molecular Weight 477.510 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_15242
Solvent DMSO-d6
Source Vendor ID: NMR/10215635; Lab Info: PE; Lab Number: NMR/9264559