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2-AMINO-4-(4'-BENZYLOXYPHENYL)-3-CYANO-5,6,7,8-TETRAHYDRO-7,7-DIMETHYL-5-OXO-4H-BENZOPYRAN
SpectraBase Compound ID L5v0ljKWfbp
InChI InChI=1S/C25H24N2O3/c1-25(2)12-20(28)23-21(13-25)30-24(27)19(14-26)22(23)17-8-10-18(11-9-17)29-15-16-6-4-3-5-7-16/h3-11,22H,12-13,15,27H2,1-2H3
InChIKey BKPDDAFJCXPSQJ-UHFFFAOYSA-N
Mol Weight 400.48 g/mol
Molecular Formula C25H24N2O3
Exact Mass 400.178693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F9ouEHK34av
Name 2-Amino-4-(4-benzoxyphenyl)-5-keto-7,7-dimethyl-6,8-dihydro-4H-chromene-3-carbonitrile
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Formula C25H24N2O3
InChI InChI=1S/C25H24N2O3/c1-25(2)12-20(28)23-21(13-25)30-24(27)19(14-26)22(23)17-8-10-18(11-9-17)29-15-16-6-4-3-5-7-16/h3-11,22H,12-13,15,27H2,1-2H3
InChIKey BKPDDAFJCXPSQJ-UHFFFAOYSA-N
Molecular Weight 400.478 g/mol
SMILES NC1=C(C(C2=C(CC(CC2=O)(C)C)O1)c1ccc(OCc2ccccc2)cc1)C#N
SPLASH splash10-0006-9010200000-b9465fa0c6ea46d192f1
Source of Spectrum AJ-41-514-4
Synonyms 2-Amino-4-(4-benzyloxyphenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile 2-Amino-4-[4-(benzyloxy)phenyl]-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile 2-Amino-7,7-dimethyl-5-oxo-4-(4-phenylmethoxyphenyl)-6,8-dihydro-4H-1-benzopyran-3-carbonitrile 2-Amino-7,7-dimethyl-5-oxo-4-(4-phenylmethoxyphenyl)-6,8-dihydro-4H-chromene-3-carbonitrile 2-Azanyl-7,7-dimethyl-5-oxidanylidene-4-(4-phenylmethoxyphenyl)-6,8-dihydro-4H-chromene-3-carbonitrile
Wiley ID 1567542