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Hexanoic acid hexyl ester
SpectraBase Compound ID 5VTwlyuGojE
InChI InChI=1S/C12H24O2/c1-3-5-7-9-11-14-12(13)10-8-6-4-2/h3-11H2,1-2H3
InChIKey NCDCLPBOMHPFCV-UHFFFAOYSA-N
Mol Weight 200.32 g/mol
Molecular Formula C12H24O2
Exact Mass 200.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9ZmXhIdvmnw
Name Hexyl hexanoate
CAS Registry Number 6378-65-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H24O2
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/C12H24O2/c1-3-5-7-9-11-14-12(13)10-8-6-4-2/h3-11H2,1-2H3
InChIKey NCDCLPBOMHPFCV-UHFFFAOYSA-N
Molecular Weight 200.322 g/mol
SMILES CCCCCCOC(=O)CCCCC
SPLASH splash10-00kf-9100000000-2a5df8a9a6e1e8c6dd94
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID 1887507