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3,7-Dimethyl-6-octen-1-ol isobutyrate
SpectraBase Compound ID LgafUQlxJaP
InChI InChI=1S/C14H26O2/c1-11(2)7-6-8-13(5)9-10-16-14(15)12(3)4/h7,12-13H,6,8-10H2,1-5H3
InChIKey ZGPPERKMXSGYRK-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 8WdFLWJuz9q
Name Citronellol isobutanoate
CAS Registry Number 97-89-2
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/c1-11(2)7-6-8-13(5)9-10-16-14(15)12(3)4/h7,12-13H,6,8-10H2,1-5H3
InChIKey ZGPPERKMXSGYRK-UHFFFAOYSA-N
Molecular Weight 226.360 g/mol
SMILES C(CC(C)CCC=C(C)C)OC(C(C)C)=O
SPLASH splash10-00l6-9100000000-1fa996423292d19633d4
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID 1887252