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3H-1,3a-Ethano-1H-cyclohepta[c]furan-3-one, hexahydro-8a-hydroxy-, (1.alpha.,3a.alpha.,8a.beta.)-(.+-.)-
SpectraBase Compound ID 9pAuuRAsiwl
InChI InChI=1S/C11H16O3/c12-9-10-5-2-1-3-6-11(10,13)8(14-9)4-7-10/h8,13H,1-7H2/t8-,10+,11-/m0/s1
InChIKey FQRICMGNAQFJBL-GDPRMGEGSA-N
Mol Weight 196.25 g/mol
Molecular Formula C11H16O3
Exact Mass 196.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3D1CiVPuJzZ
Name 3H-1,3a-Ethano-1H-cyclohepta[c]furan-3-one, hexahydro-8a-hydroxy-, (1.alpha.,3a.alpha.,8a.beta.)-(.+-.)-
Alternate Name(s) (1S*,3aR*,8aS*)-hexahydro-8a-hydroxy-3H-1,3a-ethano-1H-cyclohepta[c]furan-3-one (1S,7R,8S)-7-hydroxy-9-oxatricyclo[6.2.2.0(1,7)]dodecan-10-one
CAS Registry Number 124439-14-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16O3
InChI InChI=1S/C11H16O3/c12-9-10-5-2-1-3-6-11(10,13)8(14-9)4-7-10/h8,13H,1-7H2/t8-,10+,11-/m0/s1
InChIKey FQRICMGNAQFJBL-GDPRMGEGSA-N
Molecular Weight 196.246 g/mol
SMILES O[C@@]12[C@]3(C(O[C@@]2([H])CC3)=O)CCCCC1
SPLASH splash10-03di-0900000000-4b73282486b71a4493aa
Source of Spectrum J-55-825-23
Wiley ID 1193188