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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 3Vi7OfPiwAE
Name Oxacyclododecane-2,8-dione, 9,12-dimethyl-
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 splash10-066u-9200000000-e2d5d5e73da0fd3081dc
Source of Spectrum EP-2009-0-0
Synonyms 9,12-Dimethyloxacyclododecane-2,8-dione 9,12-dimethyl-1-oxacyclododecane-2,8-dione 9,12-dimethyl-oxacyclododecane-2,8-quinone
Wiley ID 1227548