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Linalyl phenylacetate
SpectraBase Compound ID 3tNafov8cj
InChI InChI=1S/C18H24O2/c1-5-18(4,13-9-10-15(2)3)20-17(19)14-16-11-7-6-8-12-16/h5-8,10-12H,1,9,13-14H2,2-4H3
InChIKey RROUXOOIXJRTOM-UHFFFAOYSA-N
Mol Weight 272.39 g/mol
Molecular Formula C18H24O2
Exact Mass 272.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HYljN5KUd36
Name Linalyl phenylacetate
CAS Registry Number 7143-69-3
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 272.177630011 u
Formula C18H24O2
InChI InChI=1S/C18H24O2/c1-5-18(4,13-9-10-15(2)3)20-17(19)14-16-11-7-6-8-12-16/h5-8,10-12H,1,9,13-14H2,2-4H3
InChIKey RROUXOOIXJRTOM-UHFFFAOYSA-N
Molecular Weight 272.388 g/mol
Number of Peaks 50
RI1 1840
RI2 1517
SMILES C=CC(CCC=C(C)C)(C)OC(=O)Cc1ccccc1
SPLASH splash10-0006-9000000000-af3bf2b6254cc0255c43
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 Benzeneacetic acid, 1-ethenyl-1,5-dimethyl-4-hexenyl ester
Wiley ID LM_FFNSC3_1231