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(2aS*,4R*,4aS*,6S*,6aS*,6bR*)-6-Iodo-2-oxo-octahydro-1-oxacyclopenta[cd]pentalene-4-carboxylic acid
SpectraBase Compound ID 1ckRL0IM92Y
InChI InChI=1S/C10H11IO4/c11-6-2-3-4(9(12)13)1-5-7(3)8(6)15-10(5)14/h3-8H,1-2H2,(H,12,13)/t3-,4-,5+,6+,7-,8-/m1/s1
InChIKey NUSJICBXMOZWCZ-YQOPPWPCSA-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 KdAGUJkmmsa
Name (2aS*,4R*,4aS*,6S*,6aS*,6bR*)-6-Iodo-2-oxo-octahydro-1-oxacyclopenta[cd]pentalene-4-carboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H11IO4
InChI InChI=1S/C10H11IO4/c11-6-2-3-4(9(12)13)1-5-7(3)8(6)15-10(5)14/h3-8H,1-2H2,(H,12,13)/t3-,4-,5+,6+,7-,8-/m1/s1
InChIKey NUSJICBXMOZWCZ-YQOPPWPCSA-N
Molecular Weight 322.098 g/mol
SMILES OC([C@]1([C@@]2([C@@]3([C@@](C(=O)O[C@@]3([C@@](I)(C2)[H])[H])(C1)[H])[H])[H])[H])=O
SPLASH splash10-0a4i-0900000000-6bdbcd9d3e6720f5d5f5
Source of Spectrum QA-42-823-6
Synonyms (2aS,4R,4aS,6S,6aS,6bR)-6-iodo-2-oxooctahydro-2H-pentaleno[1,6-bc]furan-4-carboxylic acid
Wiley ID 862068