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Farnesylacetone
SpectraBase Compound ID K2dk1F8BPDL
InChI InChI=1S/C18H30O/c1-15(2)9-6-10-16(3)11-7-12-17(4)13-8-14-18(5)19/h9,11,13H,6-8,10,12,14H2,1-5H3/b16-11+,17-13+
InChIKey LTUMRKDLVGQMJU-IUBLYSDUSA-N
Mol Weight 262.44 g/mol
Molecular Formula C18H30O
Exact Mass 262.229666 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4pvEhrMO9o
Name Farnesyl acetone<5E,9E->
CAS Registry Number 1117-52-8
Copyright Database Compilation Copyright © 2023-2025 John Wiley and Sons, Inc. Copyright © 2023-2025 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 262.229665585 u
Formula C18H30O
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 μm film thickness)
GC Oven Program 60 °C to 246 °C at 3 °C/min.
InChI InChI=1S/C18H30O/c1-15(2)9-6-10-16(3)11-7-12-17(4)13-8-14-18(5)19/h9,11,13H,6-8,10,12,14H2,1-5H3/b16-11+,17-13+
InChIKey LTUMRKDLVGQMJU-IUBLYSDUSA-N
Molecular Weight 262.437 g/mol
Nominal Mass 262 u
Number of Peaks 123
SMILES C(\C(=C\CC\C(=C\CCC(C)=O)C)C)CC=C(C)C
SPLASH splash10-0006-9200000000-f1e816128bd0bfd3f000
Source ex BEDOUKIAN RES.
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID RA001631