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Leiocarpin A
SpectraBase Compound ID C8PhXzfF6zN
InChI InChI=1S/C13H14O4/c14-11-7-9-6-10(17-11)12(15)13(16-9)8-4-2-1-3-5-8/h1-5,9-10,12-13,15H,6-7H2/t9-,10-,12?,13+/m0/s1
InChIKey ZPVLUTBGTWEMGV-GQXHLNNXSA-N
Mol Weight 234.25 g/mol
Molecular Formula C13H14O4
Exact Mass 234.089209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9kK7Gd8aOHe
Name Leiocarpin A
Alternate Name(s) (1S,5S,7R)-8-hydroxy-7-phenyl-2,6-dioxabicyclo[3.3.1]nonan-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14O4
InChI InChI=1S/C13H14O4/c14-11-7-9-6-10(17-11)12(15)13(16-9)8-4-2-1-3-5-8/h1-5,9-10,12-13,15H,6-7H2/t9-,10-,12?,13+/m0/s1
InChIKey ZPVLUTBGTWEMGV-GQXHLNNXSA-N
Molecular Weight 234.251 g/mol
SMILES OC1[C@]2(OC(=O)C[C@@](O[C@@]1(c1ccccc1)[H])(C2)[H])[H]
SPLASH splash10-0aru-8930000000-efa34a5ce6bf5b512fa9
Source of Spectrum H1-51-2974-1
Wiley ID 817444