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Acetic acid cyclohexyl ester
SpectraBase Compound ID XkaYagjCTR
InChI InChI=1S/C8H14O2/c1-7(9)10-8-5-3-2-4-6-8/h8H,2-6H2,1H3
InChIKey YYLLIJHXUHJATK-UHFFFAOYSA-N
Mol Weight 142.2 g/mol
Molecular Formula C8H14O2
Exact Mass 142.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4JJVfE3prTh
Name Acetate
Source of Sample SAFC Cat.no. W234907
CAS Registry Number 622-45-7
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 142.099379689 u
Formula C8H14O2
InChI InChI=1S/C8H14O2/c1-7(9)10-8-5-3-2-4-6-8/h8H,2-6H2,1H3
InChIKey YYLLIJHXUHJATK-UHFFFAOYSA-N
Molecular Weight 142.198 g/mol
Number of Peaks 50
RI1 1040
RI2 712
RI3 749
RI4 702
SMILES C(C)(=O)OC1CCCCC1
SPLASH splash10-00l6-9000000000-05ef1d5b155fd47278d2
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 Acetic acid, cyclohexyl ester
Wiley ID LM_FFNSC3_307