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cis-5-benzamido-2-methyl-6-oxo-4-phenyl-1,4,5,6-tetrahydronicotinic acid, ethyl ester
SpectraBase Compound ID KNREhzbssP8
InChI InChI=1S/C22H22N2O4/c1-3-28-22(27)17-14(2)23-21(26)19(18(17)15-10-6-4-7-11-15)24-20(25)16-12-8-5-9-13-16/h4-13,18-19H,3H2,1-2H3,(H,23,26)(H,24,25)/t18-,19-/s2
InChIKey TYSVUPZNOLZSNU-PVIFGLDDSA-N
Mol Weight 378.43 g/mol
Molecular Formula C22H22N2O4
Exact Mass 378.157957 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID BtymR4PQd02
Name cis-5-BENZAMIDO-2-METHYL-6-OXO-4-PHENYL-1,4,5,6-TETRAHYDRONICOTINIC ACID, ETHYL ESTER
Source of Sample A. Maquestiau and J.-J. Vanden Eynde, and P. Papleux, State University of Mons, Mons, Belgium
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H22N2O4
InChI InChI=1S/C22H22N2O4/c1-3-28-22(27)17-14(2)23-21(26)19(18(17)15-10-6-4-7-11-15)24-20(25)16-12-8-5-9-13-16/h4-13,18-19H,3H2,1-2H3,(H,23,26)(H,24,25)/t18-,19-/s2
InChIKey TYSVUPZNOLZSNU-PVIFGLDDSA-N
Literature Reference BULL. SOC. CHIM. BELG. 94, 849(1985) Abstract-Chemical Abstracts= 106, 18321X(1987)
Melting Point 200-201C
Molecular Weight 378.428009
Synonyms NICOTINIC ACID, 5-BENZAMIDO- 2-METHYL-6-OXO-4-PHENYL-1,4,5,6-TETRA- HYDRO-, ETHYL ESTER, CIS-,
Technique KBr WAFER