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(2S,3S,6S)-3-methyl-2-(3-oxidanylidenebutyl)-6-propan-2-yl-cyclohexan-1-one
SpectraBase Compound ID Jn1TCPqW37x
InChI InChI=1S/C14H24O2/c1-9(2)12-7-5-10(3)13(14(12)16)8-6-11(4)15/h9-10,12-13H,5-8H2,1-4H3/t10-,12-,13-/m0/s1
InChIKey HFYPDKJHTWHBIY-DRZSPHRISA-N
Mol Weight 224.34 g/mol
Molecular Formula C14H24O2
Exact Mass 224.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 32vf8peh1ae
Name (2S,3S,6S)-3-methyl-2-(3-oxidanylidenebutyl)-6-propan-2-yl-cyclohexan-1-one
Alternate Name(s) (2S,3S,6S)-3-methyl-2-(3-oxobutyl)-6-propan-2-yl-1-cyclohexanone (2S,3S,6S)-3-methyl-2-(3-oxobutyl)-6-propan-2-ylcyclohexan-1-one (2S,3S,6S)-6-isopropyl-2-(3-ketobutyl)-3-methyl-cyclohexanone (2S,3S,6S)-6-isopropyl-3-methyl-2-(3-oxobutyl)cyclohexanone
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Formula C14H24O2
InChI InChI=1S/C14H24O2/c1-9(2)12-7-5-10(3)13(14(12)16)8-6-11(4)15/h9-10,12-13H,5-8H2,1-4H3/t10-,12-,13-/m0/s1
InChIKey HFYPDKJHTWHBIY-DRZSPHRISA-N
Molecular Weight 224.344 g/mol
SMILES C1([C@@](CCC(=O)C)([C@@](C)(CC[C@]1(C(C)C)[H])[H])[H])=O
SPLASH splash10-05fr-2980000000-e95ffeb86513624ab636
Source of Spectrum KC-0-193-11
Wiley ID 829757