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Nonanoic acid, allyl ester
SpectraBase Compound ID IqMF0iXEEXi
InChI InChI=1S/C12H22O2/c1-3-5-6-7-8-9-10-12(13)14-11-4-2/h4H,2-3,5-11H2,1H3
InChIKey MFLWLDDOGSNSKO-UHFFFAOYSA-N
Mol Weight 198.31 g/mol
Molecular Formula C12H22O2
Exact Mass 198.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C1RpRGXnroc
Name Allyl nonanoate
CAS Registry Number 7493-72-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H22O2
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m film thickness)
GC Oven Program 60 ??C to 246 ??C at 3 ??C/min.
InChI InChI=1S/C12H22O2/c1-3-5-6-7-8-9-10-12(13)14-11-4-2/h4H,2-3,5-11H2,1H3
InChIKey MFLWLDDOGSNSKO-UHFFFAOYSA-N
Molecular Weight 198.306 g/mol
SMILES CCCCCCCCC(OCC=C)=O
SPLASH splash10-052f-9100000000-c9845bdab3dcf0f7d6e9
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID 1887192