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6-(2-BROMO-2-BUTANOYL)-5-METHOXY-8,8-DIMETHYL-4-PHENYL-2H,8H-BENZO-[1,2-B:3,4-B']-DIPYRAN-2-ONE

View entire compound with spectra: 1 NMR, and 1 MS (GC)

6-(2-BROMO-2-BUTANOYL)-5-METHOXY-8,8-DIMETHYL-4-PHENYL-2H,8H-BENZO-[1,2-B:3,4-B']-DIPYRAN-2-ONE
SpectraBase Compound ID JPT4CA79Vr9
InChI InChI=1S/C26H25BrO5/c1-6-26(4,27)24(29)20-22-16(12-13-25(2,3)32-22)21-19(23(20)30-5)17(14-18(28)31-21)15-10-8-7-9-11-15/h7-14H,6H2,1-5H3
InChIKey RJTAOHPVPJIAOC-UHFFFAOYSA-N
Mol Weight 497.39 g/mol
Molecular Formula C26H25BrO5
Exact Mass 496.088537 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BmNkYVPwiPS
Name 6-(2-bromanyl-2-methyl-butanoyl)-5-methoxy-8,8-dimethyl-4-phenyl-pyrano[2,3-h]chromen-2-one
Alternate Name(s) 6-(2-bromo-2-methyl-1-oxobutyl)-5-methoxy-8,8-dimethyl-4-phenyl-2-pyrano[2,3-h][1]benzopyranone 6-(2-bromo-2-methyl-butanoyl)-5-methoxy-8,8-dimethyl-4-phenyl-pyrano[2,3-h]chromen-2-one
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Formula C26H25BrO5
InChI InChI=1S/C26H25BrO5/c1-6-26(4,27)24(29)20-22-16(12-13-25(2,3)32-22)21-19(23(20)30-5)17(14-18(28)31-21)15-10-8-7-9-11-15/h7-14H,6H2,1-5H3
InChIKey RJTAOHPVPJIAOC-UHFFFAOYSA-N
Molecular Weight 497.385 g/mol
SMILES c1(c2c(C=CC(O2)(C)C)c2c(c1OC)C(=CC(O2)=O)c1ccccc1)C(C(Br)(CC)C)=O
SPLASH splash10-03di-0009600000-b354849fcb5886ce7f88
Source of Spectrum KC-0-3145-49
Wiley ID 784690