For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
cis-3-Hexenyl tiglate
SpectraBase Compound ID C2236cXRdjn
InChI InChI=1S/C11H18O2/c1-4-6-7-8-9-13-11(12)10(3)5-2/h5-7H,4,8-9H2,1-3H3/b7-6-,10-5+
InChIKey JNWQKXUWZWKUAY-JQEGGOPCSA-N
Mol Weight 182.26 g/mol
Molecular Formula C11H18O2
Exact Mass 182.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID DMeIgVEhaAw
Name Tiglate <(3Z)-hexenyl->
Source of Sample SAFC Cat.no. W393118
CAS Registry Number 67883-79-8
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 182.130679818 u
Formula C11H18O2
InChI InChI=1S/C11H18O2/c1-4-6-7-8-9-13-11(12)10(3)5-2/h5-7H,4,8-9H2,1-3H3/b7-6-,10-5+
InChIKey JNWQKXUWZWKUAY-JQEGGOPCSA-N
Molecular Weight 182.263 g/mol
Number of Peaks 50
RI1 1325
RI2 1002
RI3 1070
RI4 1027
RI5 1307
SMILES C(\C=C/CC)COC(\C(=C\C)C)=O
SPLASH splash10-00lr-9000000000-50f9c596274e6234d894
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-, (3Z)-3-hexenyl ester, (2E)-
Wiley ID LM_FFNSC3_447