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3-(1,1-dimethylprop-2-enyl)-3-(3-methylbut-2-enyl)-1H-quinoline-2,4-quinone
SpectraBase Compound ID 9zd1ggKqWiI
InChI InChI=1S/C19H23NO2/c1-6-18(4,5)19(12-11-13(2)3)16(21)14-9-7-8-10-15(14)20-17(19)22/h6-11H,1,12H2,2-5H3,(H,20,22)
InChIKey LAXFAGHIJVQGNK-UHFFFAOYSA-N
Mol Weight 297.4 g/mol
Molecular Formula C19H23NO2
Exact Mass 297.172879 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JZ2jyKomEBi
Name Buchapine
Alternate Name(s) 3-(1,1-dimethylallyl)-3-(3-methylbut-2-enyl)-1H-quinoline-2,4-dione 3-(1,1-dimethylallyl)-3-(3-methylbut-2-enyl)-1H-quinoline-2,4-quinone 3-(2-Methylbut-3-en-2-yl)-3-(3-methylbut-2-enyl)-1H-quinoline-2,4-dione
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Formula C19H23NO2
InChI InChI=1S/C19H23NO2/c1-6-18(4,5)19(12-11-13(2)3)16(21)14-9-7-8-10-15(14)20-17(19)22/h6-11H,1,12H2,2-5H3,(H,20,22)
InChIKey LAXFAGHIJVQGNK-UHFFFAOYSA-N
Molecular Weight 297.398 g/mol
SMILES N1c2c(C(C(C1=O)(CC=C(C)C)C(C=C)(C)C)=O)cccc2
SPLASH splash10-004i-0290000000-62e97c639aa340ede953
Source of Spectrum X4-18-508-0
Wiley ID 1585528