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3-Acetylbicyclo[3.3.1]nonane-2,6-dione
SpectraBase Compound ID 9RkWHUEsEN3
InChI InChI=1S/C11H14O3/c1-6(12)9-5-8-4-7(11(9)14)2-3-10(8)13/h7-8,14H,2-5H2,1H3/t7-,8+/m1/s1
InChIKey DKCMDXJHSGPUME-SFYZADRCSA-N
Mol Weight 194.23 g/mol
Molecular Formula C11H14O3
Exact Mass 194.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5DLenMEi3tG
Name 3-Acetylbicyclo[3.3.1]nonane-2,6-dione
Alternate Name(s) 7-Acetyl-6-hydroxy-bicyclo[3.3.1]non-6-en-2-one (1S,5R)-7-acetyl-6-hydroxybicyclo[3.3.1]non-6-en-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H14O3
InChI InChI=1S/C11H14O3/c1-6(12)9-5-8-4-7(11(9)14)2-3-10(8)13/h7-8,14H,2-5H2,1H3/t7-,8+/m1/s1
InChIKey DKCMDXJHSGPUME-SFYZADRCSA-N
Molecular Weight 194.230 g/mol
SMILES OC1=C(C[C@@]2(C[C@]1(CCC2=O)[H])[H])C(=O)C
SPLASH splash10-052f-9600000000-9f43257200afca5bce02
Source of Spectrum F4-46-2230-4
Wiley ID 1742223