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Propanoic acid, 2-methyl-, 1-phenylethyl ester
SpectraBase Compound ID 6KU6XP4x5A8
InChI InChI=1S/C12H16O2/c1-9(2)12(13)14-10(3)11-7-5-4-6-8-11/h4-10H,1-3H3
InChIKey JZCCYSDOUYQZMW-UHFFFAOYSA-N
Mol Weight 192.26 g/mol
Molecular Formula C12H16O2
Exact Mass 192.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1liBjRHeErV
Name Styralyl isobutyrate
CAS Registry Number 7775-39-5
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 192.115029753 u
Formula C12H16O2
InChI InChI=1S/C12H16O2/c1-9(2)12(13)14-10(3)11-7-5-4-6-8-11/h4-10H,1-3H3
InChIKey JZCCYSDOUYQZMW-UHFFFAOYSA-N
Molecular Weight 192.258 g/mol
Number of Peaks 32
RI1 1395
RI3 1142
RI4 1501
SMILES CC(C)C(=O)OC(C)c1ccccc1
SPLASH splash10-0udl-9600000000-62917fdff8ea01c56350
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 Propanoic acid, 2-methyl-, 1-phenylethyl ester
Wiley ID LM_FFNSC3_2514