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(+)-(1'R,6'S)-1-(2',2',6'-TRIMETHYLCYCLOHEXYL)-PENTAN-3-ONE
SpectraBase Compound ID 3qGwXyoC4yT
InChI InChI=1S/C14H26O/c1-5-12(15)8-9-13-11(2)7-6-10-14(13,3)4/h11,13H,5-10H2,1-4H3/t11-,13+/m0/s1
InChIKey KFDYBYSVIGXWSM-WCQYABFASA-N
Mol Weight 210.36 g/mol
Molecular Formula C14H26O
Exact Mass 210.198365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GVcH69WRwO5
Name (1'R,6'S)-1-(2',2',6'-Trimethylcyclohexyl)pentan-3-one
Alternate Name(s) 1-[(1R,6S)-2,2,6-trimethylcyclohexyl]-3-pentanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H26O
InChI InChI=1S/C14H26O/c1-5-12(15)8-9-13-11(2)7-6-10-14(13,3)4/h11,13H,5-10H2,1-4H3/t11-,13+/m0/s1
InChIKey KFDYBYSVIGXWSM-WCQYABFASA-N
Molecular Weight 210.361 g/mol
SMILES [C@]1(C(CCC[C@@]1(C)[H])(C)C)(CCC(=O)CC)[H]
SPLASH splash10-0api-9500000000-bc6830dde72a6a1c23ec
Source of Spectrum H-76-2086-22
Wiley ID 1209895