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3-tert-butyl-1-methyl-1H-benzo[g]isochromene-5,10-quinone
SpectraBase Compound ID 2U0Uahnd1W3
InChI InChI=1S/C18H18O3/c1-10-15-13(9-14(21-10)18(2,3)4)16(19)11-7-5-6-8-12(11)17(15)20/h5-10H,1-4H3
InChIKey DAESJHOMKUWVGU-UHFFFAOYSA-N
Mol Weight 282.34 g/mol
Molecular Formula C18H18O3
Exact Mass 282.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E071XmHhiuo
Name 3-tert-Butyl-1-methyl-1H-benzo[g]isochromene-5,10-dione
Alternate Name(s) 3-tert-Butyl-1-methyl-1H-benzo[g][2]benzopyran-5,10-dione 3-tert-Butyl-1-methyl-1H-benz[g]isochromene-5,10-quinone
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Formula C18H18O3
InChI InChI=1S/C18H18O3/c1-10-15-13(9-14(21-10)18(2,3)4)16(19)11-7-5-6-8-12(11)17(15)20/h5-10H,1-4H3
InChIKey DAESJHOMKUWVGU-UHFFFAOYSA-N
Molecular Weight 282.339 g/mol
SMILES C1(C2=C(C=C(O1)C(C)(C)C)C(c1ccccc1C2=O)=O)C
SPLASH splash10-052f-9300000000-48ec2d621d7f9e45b35f
Source of Spectrum KC-57-4218-14
Wiley ID 1624068