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3-[4-(4-propylcyclohexyl)cyclohexyl]cyclohexan-1-one
SpectraBase Compound ID 4tAfWUBbhln
InChI InChI=1S/C21H36O/c1-2-4-16-7-9-17(10-8-16)18-11-13-19(14-12-18)20-5-3-6-21(22)15-20/h16-20H,2-15H2,1H3
InChIKey HSODYAWIAHSLSR-UHFFFAOYSA-N
Mol Weight 304.5 g/mol
Molecular Formula C21H36O
Exact Mass 304.276616 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EkT4zGxS2oV
Name 3-[4-(4-propylcyclohexyl)cyclohexyl]cyclohexan-1-one
CAS Registry Number 101630-51-7
Comments Less than 3 mono-isotopic peaks
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Formula C21H36O
InChI InChI=1S/C21H36O/c1-2-4-16-7-9-17(10-8-16)18-11-13-19(14-12-18)20-5-3-6-21(22)15-20/h16-20H,2-15H2,1H3
InChIKey HSODYAWIAHSLSR-UHFFFAOYSA-N
Molecular Weight 304.518 g/mol
SMILES C1(CC(=O)CCC1)C1CCC(CC1)C1CCC(CC1)CCC
SPLASH splash10-0udi-0019000000-145ee6347eba17931c79
Source of Spectrum K-119-394-6
Wiley ID 1307043