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(2E,6Z)-Nonadienyl tiglate
SpectraBase Compound ID Hwnkmv9lcuz
InChI InChI=1S/C14H22O2/c1-4-6-7-8-9-10-11-12-16-14(15)13(3)5-2/h5-7,10-11H,4,8-9,12H2,1-3H3/b7-6-,11-10+,13-5+
InChIKey VHNOJILUOLCOBW-YCOVTVMBSA-N
Mol Weight 222.33 g/mol
Molecular Formula C14H22O2
Exact Mass 222.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID El2013gRaeg
Name Nonadienyl tiglate, (2E,6Z)-
CAS Registry Number 1231959-62-8
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 222.161979946 u
Formula C14H22O2
InChI InChI=1S/C14H22O2/c1-4-6-7-8-9-10-11-12-16-14(15)13(3)5-2/h5-7,10-11H,4,8-9,12H2,1-3H3/b7-6-,11-10+,13-5+
InChIKey VHNOJILUOLCOBW-YCOVTVMBSA-N
Molecular Weight 222.328 g/mol
Number of Peaks 48
RI1 1629
RI2 1308
RI3 1440
RI4 1400
RI5 1606
SMILES C\C(C(=O)OC\C=C\CC\C=C/CC)=C/C
SPLASH splash10-05o3-9000000000-f0cfc0e2573a12ccd33d
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-, (2E,6Z)-2,6-nonadien-1-yl ester, (2E)-
Wiley ID LM_FFNSC3_3423