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cis-3-HEXEN-1-OL, trans-CINNAMATE
SpectraBase Compound ID KSZKpP5duUS
InChI InChI=1S/C15H18O2/c1-2-3-4-8-13-17-15(16)12-11-14-9-6-5-7-10-14/h3-7,9-12H,2,8,13H2,1H3/b4-3-,12-11+
InChIKey FKWGVMQNGUQXDN-FECXASIGSA-N
Mol Weight 230.31 g/mol
Molecular Formula C15H18O2
Exact Mass 230.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6XZklrW25w6
Name Prop-2-enoic acid <3-phenyl-, 3-cis-hexenyl-> ester
CAS Registry Number 68133-75-5
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 230.130679818 u
Formula C15H18O2
InChI InChI=1S/C15H18O2/c1-2-3-4-8-13-17-15(16)12-11-14-9-6-5-7-10-14/h3-7,9-12H,2,8,13H2,1H3/b4-3-,12-11+
InChIKey FKWGVMQNGUQXDN-FECXASIGSA-N
Molecular Weight 230.307 g/mol
Number of Peaks 50
RI1 1886
RI2 1562
SMILES c1cccc(c1)\C=C\C(OCC\C=C/CC)=O
SPLASH splash10-001i-9700000000-21419086ebff9270a04c
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-, (3Z)-3-hexenyl ester
Wiley ID LM_FFNSC3_1371