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4-(3-chlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester
SpectraBase Compound ID 4a3Yvhy85gs
InChI InChI=1S/C19H22ClNO4/c1-5-24-18(22)15-11(3)21-12(4)16(19(23)25-6-2)17(15)13-8-7-9-14(20)10-13/h7-10,17,21H,5-6H2,1-4H3
InChIKey CKVDBTXSHZUJOU-UHFFFAOYSA-N
Mol Weight 363.84 g/mol
Molecular Formula C19H22ClNO4
Exact Mass 363.123736 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HmJsE0Mnted
Name 4-(3-chlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester
Alternate Name(s) diethyl 4-(3-chlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C19H22ClNO4
InChI InChI=1S/C19H22ClNO4/c1-5-24-18(22)15-11(3)21-12(4)16(19(23)25-6-2)17(15)13-8-7-9-14(20)10-13/h7-10,17,21H,5-6H2,1-4H3
InChIKey CKVDBTXSHZUJOU-UHFFFAOYSA-N
Molecular Weight 363.841 g/mol
SMILES N1C(=C(C(C(=C1C)C(=O)OCC)c1cc(Cl)ccc1)C(=O)OCC)C
SPLASH splash10-03di-0009000000-e2b24c9bda8c682c5d17
Source of Spectrum AJ-42-972-5
Wiley ID 1568098