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cis-5-acetamido-2-methyl-6-oxo-4-phenyl-1,4,5,6-tetrahydronicotinic acid, ethyl ester
SpectraBase Compound ID 4Wvg2Ceq3n4
InChI InChI=1S/C17H20N2O4/c1-4-23-17(22)13-10(2)18-16(21)15(19-11(3)20)14(13)12-8-6-5-7-9-12/h5-9,14-15H,4H2,1-3H3,(H,18,21)(H,19,20)/t14-,15-/s2
InChIKey XHFSURGOLRXNCY-PTTDRDKLSA-N
Mol Weight 316.36 g/mol
Molecular Formula C17H20N2O4
Exact Mass 316.142307 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID ICoiZ3qJXoL
Name cis-5-ACETAMIDO-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 C17H20N2O4
InChI InChI=1S/C17H20N2O4/c1-4-23-17(22)13-10(2)18-16(21)15(19-11(3)20)14(13)12-8-6-5-7-9-12/h5-9,14-15H,4H2,1-3H3,(H,18,21)(H,19,20)/t14-,15-/s2
InChIKey XHFSURGOLRXNCY-PTTDRDKLSA-N
Literature Reference BULL. SOC. CHIM. BELG. 94, 849(1985) Abstract-Chemical Abstracts= 106, 18321X(1987)
Melting Point 185-186C
Molecular Weight 316.356995
Synonyms NICOTINIC ACID, 5-ACETAMIDO- 2-METHYL-6-OXO-4-PHENYL-1,4,5,6-TETRA- HYDRO-, ETHYL ESTER, CIS-,
Technique KBr WAFER