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2H-1,3-thiazine-6-carboxylic acid, 2-[[4-(ethoxycarbonyl)phenyl]imino]-3-[2-(2-fluorophenyl)ethyl]-3,4-dihydro-4-oxo-,
SpectraBase Compound ID CojogREvjFa
InChI InChI=1S/C23H21FN2O5S/c1-3-31-21(28)16-8-10-17(11-9-16)25-23-26(13-12-15-6-4-5-7-18(15)24)20(27)14-19(32-23)22(29)30-2/h4-11,14H,3,12-13H2,1-2H3/b25-23-
InChIKey YQZMHFUNURWWDS-BZZOAKBMSA-N
Mol Weight 456.49 g/mol
Molecular Formula C23H21FN2O5S
Exact Mass 456.115521 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2NLqu4gbIG
Name 2H-1,3-thiazine-6-carboxylic acid, 2-[[4-(ethoxycarbonyl)phenyl]imino]-3-[2-(2-fluorophenyl)ethyl]-3,4-dihydro-4-oxo-,
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 456.115521116 u
Formula C23H21FN2O5S
InChI InChI=1S/C23H21FN2O5S/c1-3-31-21(28)16-8-10-17(11-9-16)25-23-26(13-12-15-6-4-5-7-18(15)24)20(27)14-19(32-23)22(29)30-2/h4-11,14H,3,12-13H2,1-2H3/b25-23-
InChIKey YQZMHFUNURWWDS-BZZOAKBMSA-N
Molecular Weight 456.488 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_2098
Solvent DMSO-d6
Source Vendor ID: NMR/13236565; Lab Info: PE; Lab Number: PE-0403060