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4H-Pyran-3-carboxylic acid, 5-cyano-4-(3-methoxyphenyl)-2-methyl-6-(1H-pyrrol-1-yl)-, ethyl ester
SpectraBase Compound ID 97ZhFs65LQp
InChI InChI=1S/C21H20N2O4/c1-4-26-21(24)18-14(2)27-20(23-10-5-6-11-23)17(13-22)19(18)15-8-7-9-16(12-15)25-3/h5-12,19H,4H2,1-3H3
InChIKey NXVHRNMDTGBVJL-UHFFFAOYSA-N
Mol Weight 364.4 g/mol
Molecular Formula C21H20N2O4
Exact Mass 364.142307 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ks69YVNDLLw
Name 4H-Pyran-3-carboxylic acid, 5-cyano-4-(3-methoxyphenyl)-2-methyl-6-(1H-pyrrol-1-yl)-, ethyl ester
Alternate Name(s) Ethyl 5-cyano-4-(3-methoxyphenyl)-2-methyl-6-(1H-pyrrol-1-yl)-4H-pyran-3-carboxylate 5-cyano-4-(3-methoxyphenyl)-2-methyl-6-(1-pyrrolyl)-4H-pyran-3-carboxylic acid ethyl ester Ethyl 5-cyano-4-(3-methoxyphenyl)-2-methyl-6-pyrrol-1-yl-4H-pyran-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H20N2O4
InChI InChI=1S/C21H20N2O4/c1-4-26-21(24)18-14(2)27-20(23-10-5-6-11-23)17(13-22)19(18)15-8-7-9-16(12-15)25-3/h5-12,19H,4H2,1-3H3
InChIKey NXVHRNMDTGBVJL-UHFFFAOYSA-N
Molecular Weight 364.401 g/mol
SMILES C1(=C(OC([n]2cccc2)=C(C#N)C1c1cc(ccc1)OC)C)C(=O)OCC
SPLASH splash10-0aor-7595000000-f37c5c44520a8a7f7017
Source of Spectrum IY-2-4844-6
Wiley ID 1656669