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[(3aR,4R,5S,6R,6aR)-5-hydroxy-6-iodo-2-oxo-3,3a,4,5,6,6a-hexahydrocyclopenta[b]furan-4-yl]methyl acetate
SpectraBase Compound ID KgMyvLnFGwz
InChI InChI=1S/C10H13IO5/c1-4(12)15-3-6-5-2-7(13)16-10(5)8(11)9(6)14/h5-6,8-10,14H,2-3H2,1H3/t5-,6+,8-,9+,10-/m1/s1
InChIKey PVLUMCPCWYZZSP-OLBICGFXSA-N
Mol Weight 340.11 g/mol
Molecular Formula C10H13IO5
Exact Mass 339.980769 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8kzoocyzuqH
Name [(3aR,4R,5S,6R,6aR)-5-hydroxy-6-iodo-2-oxo-3,3a,4,5,6,6a-hexahydrocyclopenta[b]furan-4-yl]methyl acetate
Alternate Name(s) [(3aR,4R,5S,6R,6aR)-6-iodanyl-5-oxidanyl-2-oxidanylidene-3,3a,4,5,6,6a-hexahydrocyclopenta[b]furan-4-yl]methyl ethanoate Acetic acid [(3aR,4R,5S,6R,6aR)-5-hydroxy-6-iodo-2-oxo-3,3a,4,5,6,6a-hexahydrocyclopenta[b]furan-4-yl]methyl ester
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Formula C10H13IO5
InChI InChI=1S/C10H13IO5/c1-4(12)15-3-6-5-2-7(13)16-10(5)8(11)9(6)14/h5-6,8-10,14H,2-3H2,1H3/t5-,6+,8-,9+,10-/m1/s1
InChIKey PVLUMCPCWYZZSP-OLBICGFXSA-N
Molecular Weight 340.113 g/mol
SMILES O[C@@]1([C@]([C@]2([C@@]([C@@]1(COC(=O)C)[H])(CC(O2)=O)[H])[H])(I)[H])[H]
SPLASH splash10-0udl-9620000000-079f9caac38ab85d00c1
Source of Spectrum KD-12-1791-26
Wiley ID 1634608