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3-Ethyl-1-methyl-4-methylethyl-bicyclo[2.2.2]octan-2-one
SpectraBase Compound ID FnqCb8THzOI
InChI InChI=1S/C14H24O/c1-5-11-12(15)13(4)6-8-14(11,9-7-13)10(2)3/h10-11H,5-9H2,1-4H3/t11-,13-,14+/m0/s1
InChIKey WBFDYBHKTPKTSA-FPMFFAJLSA-N
Mol Weight 208.34 g/mol
Molecular Formula C14H24O
Exact Mass 208.182715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JCLlztlwwIj
Name 3-Ethyl-1-methyl-4-methylethyl-bicyclo[2.2.2]octan-2-one
Classification Ketones
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 208.182715392 u
Formula C14H24O
InChI InChI=1S/C14H24O/c1-5-11-12(15)13(4)6-8-14(11,9-7-13)10(2)3/h10-11H,5-9H2,1-4H3/t11-,13-,14+/m0/s1
InChIKey WBFDYBHKTPKTSA-FPMFFAJLSA-N
Molecular Weight 208.345 g/mol
Number of Peaks 12
SMILES C1[C@]2([C@](C([C@@](C1)(CC2)C)=O)(CC)[H])C(C)C
SPLASH splash10-000j-2910000000-42a1638a0b808c90ee13
Source of Spectrum FF-8-300-18 (DOI: 10.1002/ffj.2730080603)
Synonyms (1R,3S,4R)-3-ethyl-4-isopropyl-1-methylbicyclo[2.2.2]octan-2-one
Wiley ID 1801259