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1,3-Cyclohexanedione, 2-(2,2-dimethylpropylidene)-
SpectraBase Compound ID JP2EqhlaC7U
InChI InChI=1S/C11H16O2/c1-11(2,3)7-8-9(12)5-4-6-10(8)13/h7H,4-6H2,1-3H3
InChIKey WRNZHVUNMJKMOP-UHFFFAOYSA-N
Mol Weight 180.25 g/mol
Molecular Formula C11H16O2
Exact Mass 180.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kmdz0lOxyTB
Name 1,3-Cyclohexanedione, 2-(2,2-dimethylpropylidene)-
Alternate Name(s) 2-(2,2-dimethylpropylidene)-1,3-cyclohexanedione 2-(2,2-Dimethylpropylidene)cyclohexane-1,3-dione
CAS Registry Number 127930-92-1
Comments Less than 3 mono-isotopic peaks
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Formula C11H16O2
InChI InChI=1S/C11H16O2/c1-11(2,3)7-8-9(12)5-4-6-10(8)13/h7H,4-6H2,1-3H3
InChIKey WRNZHVUNMJKMOP-UHFFFAOYSA-N
Molecular Weight 180.247 g/mol
SMILES C1(=CC(C)(C)C)C(=O)CCCC1=O
SPLASH splash10-014i-0900000000-eab2cbef059cc7468089
Source of Spectrum H-72-978-4
Wiley ID 1176560