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3,6-Methanobenzofuran-8-carboxylic acid, octahydro-7-iodo-2-oxo-, (3.alpha.,3a.beta.,6.alpha.,7.beta.,7a.beta.,8R*)-
SpectraBase Compound ID CmAaQSUKDNa
InChI InChI=1S/C10H11IO4/c11-7-3-1-2-4-6(5(3)9(12)13)10(14)15-8(4)7/h3-8H,1-2H2,(H,12,13)/t3-,4+,5+,6+,7+,8-/m0/s1
InChIKey DHNWYDREQJJAOB-UFHHHNHISA-N
Mol Weight 322.1 g/mol
Molecular Formula C10H11IO4
Exact Mass 321.970204 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FcROP0c4edV
Name 3,6-Methanobenzofuran-8-carboxylic acid, octahydro-7-iodo-2-oxo-, (3.alpha.,3a.beta.,6.alpha.,7.beta.,7a.beta.,8R*)-
Alternate Name(s) (1S,2R,3S,6S,7R,10R)-2-iodo-5-oxo-4-oxatricyclo[4.3.1.0(3,7)]decane-10-carboxylic acid endo-3-carboxy-exo-5-iodobicyclo[2.2.2]octane-2,6-carbolactone
CAS Registry Number 79813-34-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H11IO4
InChI InChI=1S/C10H11IO4/c11-7-3-1-2-4-6(5(3)9(12)13)10(14)15-8(4)7/h3-8H,1-2H2,(H,12,13)/t3-,4+,5+,6+,7+,8-/m0/s1
InChIKey DHNWYDREQJJAOB-UFHHHNHISA-N
Molecular Weight 322.098 g/mol
SMILES OC([C@]1([C@@]2(C(O[C@@]3([C@@](I)([H])[C@@]1([H])CC[C@]23[H])[H])=O)[H])[H])=O
SPLASH splash10-00dj-0819000000-477c069953c0205e383f
Source of Spectrum B-34-1724-0
Wiley ID 1321220