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Cinnamyl tiglate
SpectraBase Compound ID HXGxttbwd4Y
InChI InChI=1S/C14H16O2/c1-3-12(2)14(15)16-11-7-10-13-8-5-4-6-9-13/h3-10H,11H2,1-2H3/b10-7+,12-3+
InChIKey KRNURAJANZKGQN-IBIBRXRCSA-N
Mol Weight 216.28 g/mol
Molecular Formula C14H16O2
Exact Mass 216.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6Ju71ajyOyK
Name Cinnamyl tiglate, (E)
CAS Registry Number 61792-12-9
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 216.115029753 u
Formula C14H16O2
InChI InChI=1S/C14H16O2/c1-3-12(2)14(15)16-11-7-10-13-8-5-4-6-9-13/h3-10H,11H2,1-2H3/b10-7+,12-3+
InChIKey KRNURAJANZKGQN-IBIBRXRCSA-N
Molecular Weight 216.280 g/mol
Number of Peaks 45
RI1 1797
RI2 1475
RI3 1930
RI4 1896
RI5 1756
SMILES C(\C(C)=C\C)(=O)OC\C=C\c1ccccc1
SPLASH splash10-05o0-9300000000-3dab8ed3fc884fc20338
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-Butenoic acid, 2-methyl-, 3-phenyl-2-propen-1-yl ester, (2E)-
Wiley ID LM_FFNSC3_3409