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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 7tBReqfahJJ
Name citronellyl isobutyrate
Carrier Gas Helium
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Exact Mass 226.193280075 u
Formula C14H26O2
GC Column DB-1 (60 m x 0.25 mm, film thickness 0.25 micrometer)
GC Oven Program Oven temp 210oC
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
Instrument Name HP5890 series II GC-Hitachi model M-2500 MSD
Ionization Type EI
Literature Reference DOI 10.1002/jhrc.1240181105
Molecular Weight 226.360 g/mol
Quality 205
SMILES CC(C)=CCCC(CCOC(=O)C(C)C)C
SPLASH splash10-008a-9300000000-e400540e6b73735d99df
Source of Spectrum HRC-18-703-citronellyl isobutyrate (DOI: 10.1002/jhrc.1240181105)
Wiley ID 1910858