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3-[1-(p-CHLOROBENZYL)-1,6-DIHYDRO-6-OXONICOTINAMIDO]-2-THIOPHENECARBOXYLIC ACID, METHYL ESTER

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3-[1-(p-CHLOROBENZYL)-1,6-DIHYDRO-6-OXONICOTINAMIDO]-2-THIOPHENECARBOXYLIC ACID, METHYL ESTER
SpectraBase Compound ID 23bnA3jUCUy
InChI InChI=1S/C19H15ClN2O4S/c1-26-19(25)17-15(8-9-27-17)21-18(24)13-4-7-16(23)22(11-13)10-12-2-5-14(20)6-3-12/h2-9,11H,10H2,1H3,(H,21,24)
InChIKey FQQKHBFXFGVLCG-UHFFFAOYSA-N
Mol Weight 402.85 g/mol
Molecular Formula C19H15ClN2O4S
Exact Mass 402.044106 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BoATC4ZOsa5
Name 3-[1-(p-CHLOROBENZYL)-1,6-DIHYDRO-6-OXONICOTINAMIDO]-2-THIOPHENECARBOXYLIC ACID, METHYL ESTER
Source of Sample Bionet Research Ltd., Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H15ClN2O4S
InChI InChI=1S/C19H15ClN2O4S/c1-26-19(25)17-15(8-9-27-17)21-18(24)13-4-7-16(23)22(11-13)10-12-2-5-14(20)6-3-12/h2-9,11H,10H2,1H3,(H,21,24)
InChIKey FQQKHBFXFGVLCG-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 194-196C
Molecular Weight 402.86
Solvent CDCl3; Reference=TMS; Temperature 297K