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4H-Pyran-3-carboxylic acid, 5-cyano-4-(4-fluorophenyl)-2-methyl-6-(1H-pyrrol-1-yl)-, ethyl ester
SpectraBase Compound ID 2jnjTyU4qig
InChI InChI=1S/C20H17FN2O3/c1-3-25-20(24)17-13(2)26-19(23-10-4-5-11-23)16(12-22)18(17)14-6-8-15(21)9-7-14/h4-11,18H,3H2,1-2H3
InChIKey AOEIYMJUMUWBEP-UHFFFAOYSA-N
Mol Weight 352.37 g/mol
Molecular Formula C20H17FN2O3
Exact Mass 352.122321 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K1BOPaXzBxw
Name 4H-Pyran-3-carboxylic acid, 5-cyano-4-(4-fluorophenyl)-2-methyl-6-(1H-pyrrol-1-yl)-, ethyl ester
Alternate Name(s) 5-cyano-4-(4-fluorophenyl)-2-methyl-6-(1-pyrrolyl)-4H-pyran-3-carboxylic acid ethyl ester Ethyl 5-cyano-4-(4-fluorophenyl)-2-methyl-6-pyrrol-1-yl-4H-pyran-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H17FN2O3
InChI InChI=1S/C20H17FN2O3/c1-3-25-20(24)17-13(2)26-19(23-10-4-5-11-23)16(12-22)18(17)14-6-8-15(21)9-7-14/h4-11,18H,3H2,1-2H3
InChIKey AOEIYMJUMUWBEP-UHFFFAOYSA-N
Molecular Weight 352.365 g/mol
SMILES C1(=C(C)OC([n]2cccc2)=C(C#N)C1c1ccc(cc1)F)C(=O)OCC
SPLASH splash10-0pi0-5697000000-8ff30a52e38b671712de
Source of Spectrum IY-1-4672-9
Wiley ID 1654712