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(2S,8R)-2-ethyl-8-hexyl-oxocane

View entire compound with spectra: 1 MS (GC)

(2S,8R)-2-ethyl-8-hexyl-oxocane
SpectraBase Compound ID LbeUt26Qupd
InChI InChI=1S/C15H30O/c1-3-5-6-8-12-15-13-10-7-9-11-14(4-2)16-15/h14-15H,3-13H2,1-2H3/t14-,15+/m0/s1
InChIKey ISFPYBWSLFZCIM-LSDHHAIUSA-N
Mol Weight 226.4 g/mol
Molecular Formula C15H30O
Exact Mass 226.229666 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6J7Xw29k3Bd
Name (2S,8R)-2-ethyl-8-hexyl-oxocane
CAS Registry Number 80685-17-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H30O
InChI InChI=1S/C15H30O/c1-3-5-6-8-12-15-13-10-7-9-11-14(4-2)16-15/h14-15H,3-13H2,1-2H3/t14-,15+/m0/s1
InChIKey ISFPYBWSLFZCIM-LSDHHAIUSA-N
Molecular Weight 226.404 g/mol
SMILES [C@@]1(O[C@@](CCCCC1)(CCCCCC)[H])(CC)[H]
SPLASH splash10-0ac3-9200000000-12830297af162cb39266
Source of Spectrum J-54-5161-7
Wiley ID 1228173