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5-cyano-4-[p-(dimethylamino)phenyl]-2-methyl-6-(methylthio)nicotinic acid, ethyl ester

View entire compound with spectra: 2 NMR, and 1 FTIR

5-cyano-4-[p-(dimethylamino)phenyl]-2-methyl-6-(methylthio)nicotinic acid, ethyl ester
SpectraBase Compound ID 8ung9Hm4zX0
InChI InChI=1S/C19H21N3O2S/c1-6-24-19(23)16-12(2)21-18(25-5)15(11-20)17(16)13-7-9-14(10-8-13)22(3)4/h7-10H,6H2,1-5H3
InChIKey MHHYYXMHTBCFLM-UHFFFAOYSA-N
Mol Weight 355.46 g/mol
Molecular Formula C19H21N3O2S
Exact Mass 355.135448 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FRfoemsR8oq
Name 5-CYANO-4-[p-(DIMETHYLAMINO)PHENYL]-2-METHYL-6-(METHYLTHIO)NICOTINIC ACID, ETHYL ESTER
Source of Sample G. H. Elgemeie, Cairo University (Bani Suef Branch), Bani Suef, Egypt
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H21N3O2S
InChI InChI=1S/C19H21N3O2S/c1-6-24-19(23)16-12(2)21-18(25-5)15(11-20)17(16)13-7-9-14(10-8-13)22(3)4/h7-10H,6H2,1-5H3
InChIKey MHHYYXMHTBCFLM-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 138-140C
Molecular Weight 355.46
Solvent CDCl3; Reference=TMS; Temperature 297K