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(2aS*,4aS*,6S*,6aS*,6bS*)-4,6-Diiodo-octahydro-1-oxacyclopenta[cd]pentalen-2-one isomer
SpectraBase Compound ID B88lGHfwzgH
InChI InChI=1S/C9H10I2O2/c10-5-2-4-7-3(5)1-6(11)8(7)13-9(4)12/h3-8H,1-2H2/t3-,4+,5?,6+,7?,8-/m1/s1
InChIKey DJBNRNJNBBHMMP-AJQXUYOYSA-N
Mol Weight 403.99 g/mol
Molecular Formula C9H10I2O2
Exact Mass 403.87702 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3hx9WQDI8nP
Name (2aS*,4aS*,6S*,6aS*,6bS*)-4,6-Diiodo-octahydro-1-oxacyclopenta[cd]pentalen-2-one isomer
Alternate Name(s) (2aS*,4aS*,6S*,6aS*,6bS*)-4,6-Diiodo-octahydro-1-oxacyclopenta[cd]pentalen-2-one (2aS,4aS,6S,6aS)-4,6-diiodooctahydro-2H-pentaleno[1,6-bc]furan-2-one
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Formula C9H10I2O2
InChI InChI=1S/C9H10I2O2/c10-5-2-4-7-3(5)1-6(11)8(7)13-9(4)12/h3-8H,1-2H2/t3-,4+,5?,6+,7?,8-/m1/s1
InChIKey DJBNRNJNBBHMMP-AJQXUYOYSA-N
Molecular Weight 403.986 g/mol
SMILES C12[C@]3(C(=O)O[C@@]2([C@@](I)(C[C@@]1(C(I)C3)[H])[H])[H])[H]
SPLASH splash10-03di-9000000000-0b6ad50725924a9736e6
Source of Spectrum QA-42-823-7
Wiley ID 862067