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2-Propanone, 1-(6,6-dimethylbicyclo[3.1.1]hept-2-en-2-yl)-
SpectraBase Compound ID 5GEZxSckfun
InChI InChI=1S/C12H18O/c1-8(13)6-9-4-5-10-7-11(9)12(10,2)3/h4,10-11H,5-7H2,1-3H3
InChIKey MIKVIBAGTDOCKH-UHFFFAOYSA-N
Mol Weight 178.27 g/mol
Molecular Formula C12H18O
Exact Mass 178.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4opog2fWOIf
Name 2-Propanone, 1-(6,6-dimethylbicyclo[3.1.1]hept-2-en-2-yl)-
Alternate Name(s) 2-Propanone, 1-(6,6-dimethylbicyclo[3.1.1]hept-2-en-2-yl)-, (1S)- 1-(6,6-dimethylbicyclo[3.1.1]hept-2-en-2-yl)acetone 10-Acetyl-.alpha.-pinene 1-[6,6-dimethylbicyclo[3.1.1]hept-2-en-2-yl]-2-propanone
CAS Registry Number 124817-24-9
Comments Less than 3 mono-isotopic peaks
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Formula C12H18O
InChI InChI=1S/C12H18O/c1-8(13)6-9-4-5-10-7-11(9)12(10,2)3/h4,10-11H,5-7H2,1-3H3
InChIKey MIKVIBAGTDOCKH-UHFFFAOYSA-N
Molecular Weight 178.275 g/mol
SMILES C12C(=CCC(C2)C1(C)C)CC(=O)C
SPLASH splash10-0006-9000000000-4ad8d92c20f9ddec4cff
Source of Spectrum F-45-1086-17
Wiley ID 1174697