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Ethyl 5-acetyl-2,6-dimethyl-4-(3'-nitrophenyl)pyridine-3-carboxylate
SpectraBase Compound ID G4uOpZm0ctx
InChI InChI=1S/C18H18N2O5/c1-5-25-18(22)16-11(3)19-10(2)15(12(4)21)17(16)13-7-6-8-14(9-13)20(23)24/h6-9H,5H2,1-4H3
InChIKey TUNCBAITJYATKY-UHFFFAOYSA-N
Mol Weight 342.35 g/mol
Molecular Formula C18H18N2O5
Exact Mass 342.121572 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KK2DtKWtrFb
Name Ethyl 5-acetyl-2,6-dimethyl-4-(3'-nitrophenyl)pyridine-3-carboxylate
Alternate Name(s) Ethyl 5-acetyl-2,6-dimethyl-4-(3-nitrophenyl)nicotinate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18N2O5
InChI InChI=1S/C18H18N2O5/c1-5-25-18(22)16-11(3)19-10(2)15(12(4)21)17(16)13-7-6-8-14(9-13)20(23)24/h6-9H,5H2,1-4H3
InChIKey TUNCBAITJYATKY-UHFFFAOYSA-N
Literature Reference DOI 10.1002/jccs.200700022
Molecular Weight 342.351 g/mol
SMILES c1(c(c(c(c(n1)C)C(=O)C)-c1cc(ccc1)[N+](=O)[O-])C(=O)OCC)C
SPLASH splash10-004l-4029000000-76592ca16b36cd86fc41
Source of Spectrum QA-54-136-3b
Wiley ID 1796286