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3-PHENYLPROPENYL-3-PHENYLALLYLATE
SpectraBase Compound ID HBfzoNIFQkn
InChI InChI=1S/C18H16O2/c19-18(14-13-17-10-5-2-6-11-17)20-15-7-12-16-8-3-1-4-9-16/h1-14H,15H2/b12-7+,14-13+
InChIKey NQBWNECTZUOWID-MZXMXVKLSA-N
Mol Weight 264.32 g/mol
Molecular Formula C18H16O2
Exact Mass 264.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6laKDImP7LW
Name Phenylallyl cinnamate
CAS Registry Number 122-69-0
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 264.115029753 u
Formula C18H16O2
InChI InChI=1S/C18H16O2/c19-18(14-13-17-10-5-2-6-11-17)20-15-7-12-16-8-3-1-4-9-16/h1-14H,15H2/b12-7+,14-13+
InChIKey NQBWNECTZUOWID-MZXMXVKLSA-N
Molecular Weight 264.324 g/mol
Number of Peaks 50
RI1 2432
RI2 2105
RI5 2359
SMILES C(\C=C\c1ccccc1)(=O)OC\C=C\c1ccccc1
SPLASH splash10-00lr-2910000000-920f47ddb075edc6e719
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 2-Propenoic acid, 3-phenyl-, 3-phenyl-2-propen-1-yl ester
Wiley ID LM_FFNSC3_3131