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(5Z)-2,6-dimethyl-4-octa-2,5,7-trienone
SpectraBase Compound ID 49TK6a92Igy
InChI InChI=1S/C10H14O/c1-5-9(4)7-10(11)6-8(2)3/h5-7H,1H2,2-4H3/b9-7-
InChIKey XUINKEIPBTYUJP-CLFYSBASSA-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 FYDbGPpYtan
Name Ocimenone
CAS Registry Number 33746-71-3
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 150.104465070 u
Formula C10H14O
InChI InChI=1S/C10H14O/c1-5-9(4)7-10(11)6-8(2)3/h5-7H,1H2,2-4H3/b9-7-
InChIKey XUINKEIPBTYUJP-CLFYSBASSA-N
Molecular Weight 150.221 g/mol
Number of Peaks 50
RI1 1232
RI2 910
SMILES C(C=C(C)C)(\C=C/(C=C)C)=O
SPLASH splash10-052u-9600000000-e6b10ceeeafd5d830967
Sample Comments RI1: measured on SLB-5ms (Hydro) RI2: measured on SLB-5ms (FAMEs) RI3: measured on Supelcowax-10 (FAMEs) RI4: measured on Supelcowax-10 (FAEEs) RI5: measured on Equity-1 (Hydro)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms 2,5,7-Octatrien-4-one, 2,6-dimethyl-, (5Z)-
Wiley ID LM_FFNSC3_1586