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benzoic acid, 4-(9-cyano-7,8-dihydro-8-[4-(methylthio)phenyl]-6-oxo-2H,6H-pyrido[2,1-b][1,3,5]thiadiazin-3(4H)-yl)-, ethyl ester

View entire compound with spectra: 1 NMR

benzoic acid, 4-(9-cyano-7,8-dihydro-8-[4-(methylthio)phenyl]-6-oxo-2H,6H-pyrido[2,1-b][1,3,5]thiadiazin-3(4H)-yl)-, ethyl ester
SpectraBase Compound ID ASITUPmjhzc
InChI InChI=1S/C24H23N3O3S2/c1-3-30-24(29)17-4-8-18(9-5-17)26-14-27-22(28)12-20(21(13-25)23(27)32-15-26)16-6-10-19(31-2)11-7-16/h4-11,20H,3,12,14-15H2,1-2H3
InChIKey SOABJRWKSTUUMN-UHFFFAOYSA-N
Mol Weight 465.59 g/mol
Molecular Formula C24H23N3O3S2
Exact Mass 465.118084 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 68eIZe7Zk4s
Name benzoic acid, 4-(9-cyano-7,8-dihydro-8-[4-(methylthio)phenyl]-6-oxo-2H,6H-pyrido[2,1-b][1,3,5]thiadiazin-3(4H)-yl)-, ethyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 465.118083958 u
Formula C24H23N3O3S2
InChI InChI=1S/C24H23N3O3S2/c1-3-30-24(29)17-4-8-18(9-5-17)26-14-27-22(28)12-20(21(13-25)23(27)32-15-26)16-6-10-19(31-2)11-7-16/h4-11,20H,3,12,14-15H2,1-2H3
InChIKey SOABJRWKSTUUMN-UHFFFAOYSA-N
Molecular Weight 465.586 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_3533
Solvent DMSO-d6
Source Vendor ID: NMR/13278557