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Allyl hexanoate
SpectraBase Compound ID CFKgienjd9C
InChI InChI=1S/C9H16O2/c1-3-5-6-7-9(10)11-8-4-2/h4H,2-3,5-8H2,1H3
InChIKey RCSBILYQLVXLJG-UHFFFAOYSA-N
Mol Weight 156.22 g/mol
Molecular Formula C9H16O2
Exact Mass 156.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B1wfBQIStiy
Name Allyl hexanoate
CAS Registry Number 123-68-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H16O2
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/C9H16O2/c1-3-5-6-7-9(10)11-8-4-2/h4H,2-3,5-8H2,1H3
InChIKey RCSBILYQLVXLJG-UHFFFAOYSA-N
Molecular Weight 156.225 g/mol
SMILES C(C(OCC=C)=O)CCCC
SPLASH splash10-0006-9000000000-7b2205a8f2d1a398bfc8
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID 1887190