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(3a.beta.,4.alpha.,7a.alpha.)-(+-)-6(E)-(Bromomethylene)-2,3,3a,4,5,6,7,7a-octahydro-3a,4-dihydroxy-7a-methyl-1-indanone
SpectraBase Compound ID 4OMC2C2fY7f
InChI InChI=1S/C11H15BrO3/c1-10-5-7(6-12)4-9(14)11(10,15)3-2-8(10)13/h6,9,14-15H,2-5H2,1H3/b7-6-/t9-,10+,11+/m0/s1
InChIKey IAAULBKGPRQGHZ-HYTBFLFESA-N
Mol Weight 275.14 g/mol
Molecular Formula C11H15BrO3
Exact Mass 274.020457 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9vCiLHvWcpD
Name (3a.beta.,4.alpha.,7a.alpha.)-(+-)-6(E)-(Bromomethylene)-2,3,3a,4,5,6,7,7a-octahydro-3a,4-dihydroxy-7a-methyl-1-indanone
Alternate Name(s) (3aS,4S,6E,7aS)-6-(bromomethylene)-3a,4-dihydroxy-7a-methyloctahydro-1H-inden-1-one
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Formula C11H15BrO3
InChI InChI=1S/C11H15BrO3/c1-10-5-7(6-12)4-9(14)11(10,15)3-2-8(10)13/h6,9,14-15H,2-5H2,1H3/b7-6-/t9-,10+,11+/m0/s1
InChIKey IAAULBKGPRQGHZ-HYTBFLFESA-N
Molecular Weight 275.142 g/mol
SMILES O[C@]1(C\C(C[C@]2([C@]1(CCC2=O)O)C)=C/Br)[H]
SPLASH splash10-004i-0960000000-fd53b11c98ec1bb73575
Source of Spectrum J-63-7839-28
Wiley ID 1277682