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5-cyano-2-methyl-4-(3-nitrophenyl)-6-(1-pyrrolyl)-4H-pyran-3-carboxylic acid ethyl ester
SpectraBase Compound ID DXUG1b0Z9X1
InChI InChI=1S/C20H17N3O5/c1-3-27-20(24)17-13(2)28-19(22-9-4-5-10-22)16(12-21)18(17)14-7-6-8-15(11-14)23(25)26/h4-11,18H,3H2,1-2H3
InChIKey ADDQMWWSSFSDPR-UHFFFAOYSA-N
Mol Weight 379.37 g/mol
Molecular Formula C20H17N3O5
Exact Mass 379.116821 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1yq8WWG6wUL
Name 5-cyano-2-methyl-4-(3-nitrophenyl)-6-(1-pyrrolyl)-4H-pyran-3-carboxylic acid ethyl ester
Alternate Name(s) 5-cyano-2-methyl-4-(3-nitrophenyl)-6-pyrrol-1-yl-4H-pyran-3-carboxylic acid ethyl ester Ethyl 5-cyano-2-methyl-4-(3-nitrophenyl)-6-(1H-pyrrol-1-yl)-4H-pyran-3-carboxylate Ethyl 5-cyano-2-methyl-4-(3-nitrophenyl)-6-pyrrol-1-yl-4H-pyran-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H17N3O5
InChI InChI=1S/C20H17N3O5/c1-3-27-20(24)17-13(2)28-19(22-9-4-5-10-22)16(12-21)18(17)14-7-6-8-15(11-14)23(25)26/h4-11,18H,3H2,1-2H3
InChIKey ADDQMWWSSFSDPR-UHFFFAOYSA-N
Molecular Weight 379.372 g/mol
SMILES C1(=C(OC([n]2cccc2)=C(C#N)C1c1cc(ccc1)N(=O)=O)C)C(=O)OCC
SPLASH splash10-0bvi-6497000000-966b7347d850be5283b0
Wiley ID 1512589