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9-Hydroxy-5,9-dimethylundec-4-enal
SpectraBase Compound ID Ca66ryZQjW9
InChI InChI=1S/C13H24O2/c1-4-13(3,15)10-7-9-12(2)8-5-6-11-14/h8,11,15H,4-7,9-10H2,1-3H3
InChIKey DLJMETPIQLEUJW-UHFFFAOYSA-N
Mol Weight 212.33 g/mol
Molecular Formula C13H24O2
Exact Mass 212.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1ApSbvbInDx
Name 9-Hydroxy-5,9-dimethylundec-4-enal
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H24O2
InChI InChI=1S/C13H24O2/c1-4-13(3,15)10-7-9-12(2)8-5-6-11-14/h8,11,15H,4-7,9-10H2,1-3H3
InChIKey DLJMETPIQLEUJW-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 212.333 g/mol
SMILES OC(CCCC(=CCCC=O)C)(CC)C
SPLASH splash10-05gj-9200000000-e3abddb603e894fdf443
Sample Comments major, E/Z = ca. 2:3
Source of Spectrum WO2016091895A1
Wiley ID 1851141