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(2S)-2-(4',4'-Dimethyl-3'-oxopentyl)-2-methylcyclohexan-1-one
SpectraBase Compound ID DgjMUDsSKxD
InChI InChI=1S/C14H24O2/c1-13(2,3)11(15)8-10-14(4)9-6-5-7-12(14)16/h5-10H2,1-4H3/t14-/m0/s1
InChIKey PBISTFLUNSDLRC-AWEZNQCLSA-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 ANY6y0qKQX7
Name (2S)-2-(4',4'-Dimethyl-3'-oxopentyl)-2-methylcyclohexan-1-one
Alternate Name(s) (S)-2-(4,4-dimethyl-3-oxopentyl)-2-methylcyclohexanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H24O2
InChI InChI=1S/C14H24O2/c1-13(2,3)11(15)8-10-14(4)9-6-5-7-12(14)16/h5-10H2,1-4H3/t14-/m0/s1
InChIKey PBISTFLUNSDLRC-AWEZNQCLSA-N
Literature Reference DOI 10.1002/anie.201409591
Molecular Weight 224.344 g/mol
SMILES C1C([C@](CCC(C(C)(C)C)=O)(CCC1)C)=O
SPLASH splash10-014r-1900000000-dcf65a058b02a56a2ae1
Source of Spectrum ACI-54-1960/SMS10-5b
Wiley ID 1761086