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Ethyl 4-(2-amino-3-cyano-5-oxo-5,6,7,8-tetrahydro-4H-chromen-4-yl)-3,5-dimethyl-1H-pyrrole-2-carboxylate
SpectraBase Compound ID DcwFYGnNwTP
InChI InChI=1S/C19H21N3O4/c1-4-25-19(24)17-9(2)14(10(3)22-17)15-11(8-20)18(21)26-13-7-5-6-12(23)16(13)15/h15,22H,4-7,21H2,1-3H3
InChIKey AAPHPQOLGDSXAQ-UHFFFAOYSA-N
Mol Weight 355.39 g/mol
Molecular Formula C19H21N3O4
Exact Mass 355.153206 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Aqs0jA9UBb
Name Ethyl 4-(2-amino-3-cyano-5-oxo-5,6,7,8-tetrahydro-4H-chromen-4-yl)-3,5-dimethyl-1H-pyrrole-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H21N3O4
InChI InChI=1S/C19H21N3O4/c1-4-25-19(24)17-9(2)14(10(3)22-17)15-11(8-20)18(21)26-13-7-5-6-12(23)16(13)15/h15,22H,4-7,21H2,1-3H3
InChIKey AAPHPQOLGDSXAQ-UHFFFAOYSA-N
Molecular Weight 355.394 g/mol
SMILES NC1=C(C(c2c([nH]c(c2C)C(=O)OCC)C)C2=C(O1)CCCC2=O)C#N
SPLASH splash10-000i-1900000000-6a067a772e58441a5488
Synonyms 4-(2-amino-3-cyano-5-keto-4,6,7,8-tetrahydrochromen-4-yl)-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester 4-(2-amino-3-cyano-5-oxo-4,6,7,8-tetrahydro-1-benzopyran-4-yl)-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester 4-(2-Amino-3-cyano-5-oxo-5,6,7,8-tetrahydro-4H-chromen-4-yl)-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester Ethyl 4-(2-amino-3-cyano-5-oxo-4,6,7,8-tetrahydrochromen-4-yl)-3,5-dimethyl-1H-pyrrole-2-carboxylate Ethyl 4-(2-azanyl-3-cyano-5-oxidanylidene-4,6,7,8-tetrahydrochromen-4-yl)-3,5-dimethyl-1H-pyrrole-2-carboxylate
Wiley ID 1463429