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

View entire compound with spectra: 1 NMR

benzoic acid, 4-(8-(4-chlorophenyl)-9-cyano-7,8-dihydro-6-oxo-2H,6H-pyrido[2,1-b][1,3,5]thiadiazin-3(4H)-yl)-, methyl ester
SpectraBase Compound ID 6PqZGjhu3MC
InChI InChI=1S/C22H18ClN3O3S/c1-29-22(28)15-4-8-17(9-5-15)25-12-26-20(27)10-18(14-2-6-16(23)7-3-14)19(11-24)21(26)30-13-25/h2-9,18H,10,12-13H2,1H3
InChIKey ZUIWQCMVHGXJNE-UHFFFAOYSA-N
Mol Weight 439.92 g/mol
Molecular Formula C22H18ClN3O3S
Exact Mass 439.07574 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8RDfJgPIwzg
Name benzoic acid, 4-(8-(4-chlorophenyl)-9-cyano-7,8-dihydro-6-oxo-2H,6H-pyrido[2,1-b][1,3,5]thiadiazin-3(4H)-yl)-, methyl 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 439.075740323 u
Formula C22H18ClN3O3S
InChI InChI=1S/C22H18ClN3O3S/c1-29-22(28)15-4-8-17(9-5-15)25-12-26-20(27)10-18(14-2-6-16(23)7-3-14)19(11-24)21(26)30-13-25/h2-9,18H,10,12-13H2,1H3
InChIKey ZUIWQCMVHGXJNE-UHFFFAOYSA-N
Molecular Weight 439.917 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_9305
Solvent DMSO-d6
Source Vendor ID: NMR/14228152