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Oxacyclododecane-2,8-dione, 9,12-dimethyl-
SpectraBase Compound ID 5mGc9GWk8NQ
InChI InChI=1S/C13H22O3/c1-10-8-9-11(2)16-13(15)7-5-3-4-6-12(10)14/h10-11H,3-9H2,1-2H3
InChIKey JTVSVAIMUGFDKG-UHFFFAOYSA-N
Mol Weight 226.32 g/mol
Molecular Formula C13H22O3
Exact Mass 226.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8W1gxUe0j6s
Name Oxacyclododecane-2,8-dione, 9,12-dimethyl-
Alternate Name(s) 9,12-Dimethyloxacyclododecane-2,8-dione 9,12-dimethyl-1-oxacyclododecane-2,8-dione 9,12-dimethyl-oxacyclododecane-2,8-quinone
CAS Registry Number 55649-87-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H22O3
InChI InChI=1S/C13H22O3/c1-10-8-9-11(2)16-13(15)7-5-3-4-6-12(10)14/h10-11H,3-9H2,1-2H3
InChIKey JTVSVAIMUGFDKG-UHFFFAOYSA-N
Molecular Weight 226.316 g/mol
SMILES C1(OC(CCCCCC(C(CC1)C)=O)=O)C
SPLASH splash10-004i-1900000000-a386e25b005def720a6d
Source of Spectrum Y-12-104-0
Wiley ID 1227549