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4-Bromo-10,14,14-trimethyl-(6bS,14aR)-14,14a-dihydro-1H,6bH,7H-chromeno[3',4':5,6]pyrano[3,4-c]chromen-7-one
SpectraBase Compound ID 7unkNcL4n7t
InChI InChI=1S/C22H19BrO4/c1-11-4-6-14-17(8-11)26-21-19(20(14)24)18-13-7-5-12(23)9-16(13)25-10-15(18)22(2,3)27-21/h4-9,15,18H,10H2,1-3H3/t15-,18+/m1/s1
InChIKey CXCXULDKMPVIJZ-QAPCUYQASA-N
Mol Weight 427.29 g/mol
Molecular Formula C22H19BrO4
Exact Mass 426.046672 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CQdiRhP0k0C
Name 4-Bromo-10,14,14-trimethyl-(6bS,14aR)-14,14a-dihydro-1H,6bH,7H-chromeno[3',4':5,6]pyrano[3,4-c]chromen-7-one
Alternate Name(s) (6aS,14bR)-3-bromo-7,7,11-trimethyl-6a,14b-dihydro-6H,7H,14H-chromeno[4',3':4,5]pyrano[2,3-b]chromen-14-one
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Formula C22H19BrO4
InChI InChI=1S/C22H19BrO4/c1-11-4-6-14-17(8-11)26-21-19(20(14)24)18-13-7-5-12(23)9-16(13)25-10-15(18)22(2,3)27-21/h4-9,15,18H,10H2,1-3H3/t15-,18+/m1/s1
InChIKey CXCXULDKMPVIJZ-QAPCUYQASA-N
Molecular Weight 427.294 g/mol
SMILES C12=C(OC([C@]3([C@@]2(c2c(OC3)cc(cc2)Br)[H])[H])(C)C)Oc2c(C1=O)ccc(C)c2
SPLASH splash10-0006-9000000000-ad10b8c7da4139f83d17
Source of Spectrum C5-2004-1787-3
Wiley ID 1617028