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Apofarnesal<(E)-dihydro->
SpectraBase Compound ID JOEbfQ5Sjc3
InChI InChI=1S/C14H24O/c1-12(2)7-5-8-13(3)9-6-10-14(4)11-15/h7,9,11,14H,5-6,8,10H2,1-4H3/b13-9+
InChIKey ZXGMEZJVBHJYEQ-UKTHLTGXSA-N
Mol Weight 208.34 g/mol
Molecular Formula C14H24O
Exact Mass 208.182715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9IduR5joPH9
Name Apofarnesal <(E)-dihydro->
Source of Sample Givaudan
CAS Registry Number 55903-90-7
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 208.182715392 u
Formula C14H24O
InChI InChI=1S/C14H24O/c1-12(2)7-5-8-13(3)9-6-10-14(4)11-15/h7,9,11,14H,5-6,8,10H2,1-4H3/b13-9+
InChIKey ZXGMEZJVBHJYEQ-UKTHLTGXSA-N
Molecular Weight 208.345 g/mol
Number of Peaks 50
RI1 1516
RI2 1192
SMILES C(=CCC\C(=C\CCC(C=O)C)C)(C)C
SPLASH splash10-014i-9100000000-920435c48b7fbac13c5b
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 5,9-Undecadienal, 2,6,10-trimethyl-
Wiley ID LM_FFNSC3_1168