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1-((1R,2R,4R)-Bicyclo[2.2.2]oct-5-en-2-yl)ethanone
SpectraBase Compound ID 7NupNqiELod
InChI InChI=1S/C10H14O/c1-7(11)10-6-8-2-4-9(10)5-3-8/h2,4,8-10H,3,5-6H2,1H3/t8-,9-,10+/m1/s1
InChIKey QPPGEPODNBLBTG-BBBLOLIVSA-N
Mol Weight 150.22 g/mol
Molecular Formula C10H14O
Exact Mass 150.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LkZjiolIkq5
Name 1-((1R,2R,4R)-Bicyclo[2.2.2]oct-5-en-2-yl)ethanone
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H14O
InChI InChI=1S/C10H14O/c1-7(11)10-6-8-2-4-9(10)5-3-8/h2,4,8-10H,3,5-6H2,1H3/t8-,9-,10+/m1/s1
InChIKey QPPGEPODNBLBTG-BBBLOLIVSA-N
Instrument Name LRMS
Ionization Type EI
Literature Reference DOI 10.1002/cctc.202100342
Molecular Weight 150.221 g/mol
SMILES C=1[C@@]2(CC[C@@](C1)([C@@](C2)(C(=O)C)[H])[H])[H]
SPLASH splash10-004i-9300000000-90d303b8b04500f898be
Sample Comments endo:exo (>50:1)
Source of Spectrum CCC-13-SM12-3aa
Wiley ID 1854262