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Linalyl butyrate
SpectraBase Compound ID FGJL1A9Ly3w
InChI InChI=1S/C14H24O2/c1-6-9-13(15)16-14(5,7-2)11-8-10-12(3)4/h7,10H,2,6,8-9,11H2,1,3-5H3
InChIKey FHLGUOHLUFIAAA-UHFFFAOYSA-N
Mol Weight 224.34 g/mol
Molecular Formula C14H24O2
Exact Mass 224.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8EWI0ET4hEF
Name Linalool butyrate
Source of Sample SAFC Cat.no. W263907
CAS Registry Number 78-36-4
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 224.177630011 u
Formula C14H24O2
InChI InChI=1S/C14H24O2/c1-6-9-13(15)16-14(5,7-2)11-8-10-12(3)4/h7,10H,2,6,8-9,11H2,1,3-5H3
InChIKey FHLGUOHLUFIAAA-UHFFFAOYSA-N
Molecular Weight 224.344 g/mol
Number of Peaks 50
RI1 1416
RI2 1095
RI3 1105
RI4 1061
SMILES CCCC(OC(C)(CCC=C(C)C)C=C)=O
SPLASH splash10-0006-9100000000-29e7714ea860591555ba
Sample Comments RI1: measured on SLB-5ms (Hydro) RI2: measured on SLB-5ms (FAMEs) RI3: measured on Supelcowax-10 (FAMEs) RI4: measured on Supelcowax-10 (FAEEs) RI5: measured on Equity-1 (Hydro)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms Butanoic acid, 1-ethenyl-1,5-dimethyl-4-hexen-1-yl ester
Wiley ID LM_FFNSC3_1919