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cis-4-hydroxy-.gamma.-dihydroionone
SpectraBase Compound ID Gr2qiqTnXMG
InChI InChI=1S/C13H22O2/c1-9(14)5-6-11-10(2)12(15)7-8-13(11,3)4/h11-12,15H,2,5-8H2,1,3-4H3/t11-,12-/m0/s1
InChIKey LXOJWAXONZMGQJ-RYUDHWBXSA-N
Mol Weight 210.32 g/mol
Molecular Formula C13H22O2
Exact Mass 210.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID wSEhZvd3Ep
Name cis-4-hydroxy-.gamma.-dihydroionone
Classification Sesquiterpenoids
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 210.161979946 u
Formula C13H22O2
InChI InChI=1S/C13H22O2/c1-9(14)5-6-11-10(2)12(15)7-8-13(11,3)4/h11-12,15H,2,5-8H2,1,3-4H3/t11-,12-/m0/s1
InChIKey LXOJWAXONZMGQJ-RYUDHWBXSA-N
Molecular Weight 210.317 g/mol
Number of Peaks 20
SMILES O[C@]1(CCC(C)(C)[C@](C1=C)(CCC(C)=O)[H])[H]
SPLASH splash10-0uxr-3900000000-5ad4f8c5db847987064b
Source of Spectrum FF-22-508-19 (DOI: 10.1002/ffj.1832)
Synonyms 4-((1R,5S)-5-hydroxy-2,2-dimethyl-6-methylenecyclohexyl)butan-2-one
Wiley ID 1775496