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Cyclohexyl salicylate
SpectraBase Compound ID 9T3YjImBpwJ
InChI InChI=1S/C13H16O3/c14-12-9-5-4-8-11(12)13(15)16-10-6-2-1-3-7-10/h4-5,8-10,14H,1-3,6-7H2
InChIKey NUQDJSMHGCTKNL-UHFFFAOYSA-N
Mol Weight 220.27 g/mol
Molecular Formula C13H16O3
Exact Mass 220.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BgW1c2hsnvV
Name Cyclohexyl salicylate
CAS Registry Number 25485-88-5
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 220.109944372 u
Formula C13H16O3
InChI InChI=1S/C13H16O3/c14-12-9-5-4-8-11(12)13(15)16-10-6-2-1-3-7-10/h4-5,8-10,14H,1-3,6-7H2
InChIKey NUQDJSMHGCTKNL-UHFFFAOYSA-N
Molecular Weight 220.268 g/mol
Number of Peaks 50
RI1 1745
RI2 1421
RI3 1901
RI4 1862
RI5 1706
SMILES Oc1c(C(=O)OC2CCCCC2)cccc1
SPLASH splash10-00dr-4900000000-2482b3afb19939a41ddb
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-, cyclohexyl ester
Wiley ID LM_FFNSC3_3274