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Octanoic acid, allyl ester
SpectraBase Compound ID Q7nlSHr6zM
InChI InChI=1S/C11H20O2/c1-3-5-6-7-8-9-11(12)13-10-4-2/h4H,2-3,5-10H2,1H3
InChIKey PZGMUSDNQDCNAG-UHFFFAOYSA-N
Mol Weight 184.28 g/mol
Molecular Formula C11H20O2
Exact Mass 184.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B0Sr8UwJ8XQ
Name Allyl octanoate
CAS Registry Number 4230-97-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H20O2
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/C11H20O2/c1-3-5-6-7-8-9-11(12)13-10-4-2/h4H,2-3,5-10H2,1H3
InChIKey PZGMUSDNQDCNAG-UHFFFAOYSA-N
Molecular Weight 184.279 g/mol
SMILES CCCCCCCC(OCC=C)=O
SPLASH splash10-0a4l-9100000000-054e7c0d563812bb5f26
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID 1887193