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3,5,7-trimethyl-1-oxacycloundecane-2,8-dione
SpectraBase Compound ID 2Yj8A0i1VLg
InChI InChI=1S/C13H22O3/c1-9-7-10(2)12(14)5-4-6-16-13(15)11(3)8-9/h9-11H,4-8H2,1-3H3
InChIKey FZONIQITBVHKQZ-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 D46L1yIs1Zw
Name 3,5,7-trimethyl-1-oxacycloundecane-2,8-dione
Alternate Name(s) 3,5,7-trimethyl-oxacycloundecane-2,8-dione 3,5,7-trimethyl-oxacycloundecane-2,8-quinone
CAS Registry Number 32971-15-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H22O3
InChI InChI=1S/C13H22O3/c1-9-7-10(2)12(14)5-4-6-16-13(15)11(3)8-9/h9-11H,4-8H2,1-3H3
InChIKey FZONIQITBVHKQZ-UHFFFAOYSA-N
Molecular Weight 226.316 g/mol
SMILES C1(C(CC(CC(C)C(CCCO1)=O)C)C)=O
SPLASH splash10-0002-9100000000-92882a23d57980f563b8
Source of Spectrum Y-12-104-0
Wiley ID 1227547