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Citronellyl acetate
SpectraBase Compound ID DBfoM8v1QyY
InChI InChI=1S/C12H22O2/c1-10(2)6-5-7-11(3)8-9-14-12(4)13/h6,11H,5,7-9H2,1-4H3
InChIKey JOZKFWLRHCDGJA-UHFFFAOYSA-N
Mol Weight 198.31 g/mol
Molecular Formula C12H22O2
Exact Mass 198.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8e5vdeOxhzl
Name Citronellyl acetate
Source of Sample Sigma-Aldrich Cat. #43646
CAS Registry Number 150-84-5
Classification Pesticides: Repellents
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 198.161979946 u
Formula C12H22O2
InChI InChI=1S/C12H22O2/c1-10(2)6-5-7-11(3)8-9-14-12(4)13/h6,11H,5,7-9H2,1-4H3
InChIKey JOZKFWLRHCDGJA-UHFFFAOYSA-N
Molecular Weight 198.306 g/mol
Number of Peaks 112
RI1 1350
SMILES CC(CCC=C(C)C)CCOC(C)=O
SPLASH splash10-015c-9100000000-57e29acc2aa44b376147
Sample Comments RI1: measured on SLB-5ms (Alkanes) RI2: measured on Equity-1 (Alkanes)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms 6-Octen-1-ol, 3,7-dimethyl-, acetate
Wiley ID LM_PEST_1135