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(2E)-Undecenyl tiglate
SpectraBase Compound ID LWDmsCOCqtw
InChI InChI=1S/C16H28O2/c1-4-6-7-8-9-10-11-12-13-14-18-16(17)15(3)5-2/h5,12-13H,4,6-11,14H2,1-3H3/b13-12+,15-5+
InChIKey WLRUABOBSSGBFR-UGLIDWPASA-N
Mol Weight 252.4 g/mol
Molecular Formula C16H28O2
Exact Mass 252.20893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FigVhYY6r1s
Name (E)-2-undecenyl tiglate
CAS Registry Number 1231960-09-0
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 252.208930140 u
Formula C16H28O2
InChI InChI=1S/C16H28O2/c1-4-6-7-8-9-10-11-12-13-14-18-16(17)15(3)5-2/h5,12-13H,4,6-11,14H2,1-3H3/b13-12+,15-5+
InChIKey WLRUABOBSSGBFR-UGLIDWPASA-N
Molecular Weight 252.398 g/mol
Number of Peaks 50
RI1 1831
RI2 1507
RI3 1587
RI4 1550
RI5 1812
SMILES C(\C(C)=C\C)(=O)OC\C=C\CCCCCCCC
SPLASH splash10-001i-9100000000-283b5fa58ed7775ba808
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)-2-undecen-1-yl ester, (2E)-
Wiley ID LM_FFNSC3_3449