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Citronellyl butyrate
SpectraBase Compound ID BFNxoGv9rEq
InChI InChI=1S/C14H26O2/c1-5-7-14(15)16-11-10-13(4)9-6-8-12(2)3/h8,13H,5-7,9-11H2,1-4H3
InChIKey XQPZQXTWYZAXAK-UHFFFAOYSA-N
Mol Weight 226.36 g/mol
Molecular Formula C14H26O2
Exact Mass 226.19328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 10UKJ1Jib4o
Name Citronellyl butanoate
CAS Registry Number 141-16-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H26O2
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/C14H26O2/c1-5-7-14(15)16-11-10-13(4)9-6-8-12(2)3/h8,13H,5-7,9-11H2,1-4H3
InChIKey XQPZQXTWYZAXAK-UHFFFAOYSA-N
Molecular Weight 226.360 g/mol
SMILES C(C(CCC=C(C)C)C)COC(CCC)=O
SPLASH splash10-00rx-9100000000-1a18e3e0a74133c37b91
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID 1887254