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(+)-(5S)-5-ETHYL-2,6,6-TRIMETHYLCYClOHEX-2-EN-1-ONE
SpectraBase Compound ID IETiBEq9xZH
InChI InChI=1S/C11H18O/c1-5-9-7-6-8(2)10(12)11(9,3)4/h6,9H,5,7H2,1-4H3/t9-/m0/s1
InChIKey QSVKQCPTISZWPM-VIFPVBQESA-N
Mol Weight 166.26 g/mol
Molecular Formula C11H18O
Exact Mass 166.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 528MIqU3vk4
Name (5S)-5-Ethyl-2,6,6-trimethylcyclohex-2-en-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H18O
InChI InChI=1S/C11H18O/c1-5-9-7-6-8(2)10(12)11(9,3)4/h6,9H,5,7H2,1-4H3/t9-/m0/s1
InChIKey QSVKQCPTISZWPM-VIFPVBQESA-N
Molecular Weight 166.264 g/mol
SMILES C1(C([C@@](CC)(CC=C1C)[H])(C)C)=O
SPLASH splash10-001i-9000000000-aedffbd4b738b586b8e6
Source of Spectrum H-76-539-2
Synonyms (5S)-5-ethyl-2,6,6-trimethyl-1-cyclohex-2-enone
Wiley ID 1163156