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Phenethyl salicylate
SpectraBase Compound ID rTWblW6u00
InChI InChI=1S/C15H14O3/c16-14-9-5-4-8-13(14)15(17)18-11-10-12-6-2-1-3-7-12/h1-9,16H,10-11H2
InChIKey YNMSDIQQNIRGDP-UHFFFAOYSA-N
Mol Weight 242.27 g/mol
Molecular Formula C15H14O3
Exact Mass 242.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2fPw17eVihP
Name Salicylate
Source of Sample SAFC Cat.no. W286818
CAS Registry Number 87-22-9
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 242.094294308 u
Formula C15H14O3
InChI InChI=1S/C15H14O3/c16-14-9-5-4-8-13(14)15(17)18-11-10-12-6-2-1-3-7-12/h1-9,16H,10-11H2
InChIKey YNMSDIQQNIRGDP-UHFFFAOYSA-N
Molecular Weight 242.274 g/mol
Number of Peaks 50
RI1 1961
RI2 1636
SMILES Oc1ccccc1C(OCCc1ccccc1)=O
SPLASH splash10-0zfr-3900000000-3b0e36de87db342ce890
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 Benzoic acid, 2-hydroxy-, 2-phenylethyl ester
Wiley ID LM_FFNSC3_781