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4-(4'-ACETAMIDOPHENYL)-2-AMINO-3-CYANO-5,6,7,8-TETRAHYDRO-7,7-DIMETHYL-5-OXO-4H-BENZOPYRAN
SpectraBase Compound ID L2HnxhXWVXZ
InChI InChI=1S/C20H21N3O3/c1-11(24)23-13-6-4-12(5-7-13)17-14(10-21)19(22)26-16-9-20(2,3)8-15(25)18(16)17/h4-7,17H,8-9,22H2,1-3H3,(H,23,24)
InChIKey MQPLIWSJVREFDY-UHFFFAOYSA-N
Mol Weight 351.41 g/mol
Molecular Formula C20H21N3O3
Exact Mass 351.158292 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3n5B92qIDeb
Name N-[4-(2-amino-3-cyano-5-keto-7,7-dimethyl-6,8-dihydro-4H-chromen-4-yl)phenyl]acetamide
Alternate Name(s) N-[4-(2-amino-3-cyano-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromen-4-yl)phenyl]acetamide N-[4-(2-amino-3-cyano-7,7-dimethyl-5-oxo-6,8-dihydro-4H-1-benzopyran-4-yl)phenyl]acetamide N-[4-(2-amino-3-cyano-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromen-4-yl)phenyl]acetamide N-[4-(2-azanyl-3-cyano-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromen-4-yl)phenyl]ethanamide
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Formula C20H21N3O3
InChI InChI=1S/C20H21N3O3/c1-11(24)23-13-6-4-12(5-7-13)17-14(10-21)19(22)26-16-9-20(2,3)8-15(25)18(16)17/h4-7,17H,8-9,22H2,1-3H3,(H,23,24)
InChIKey MQPLIWSJVREFDY-UHFFFAOYSA-N
Molecular Weight 351.406 g/mol
SMILES N(C(=O)C)c1ccc(C2C(=C(OC3=C2C(CC(C3)(C)C)=O)N)C#N)cc1
SPLASH splash10-0gb9-0197000000-f7aa3886d7a0c4575fbe
Source of Spectrum AJ-41-514-4
Wiley ID 1567541