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(3Z)-Nonenyl tiglate
SpectraBase Compound ID 3Gbs7HuptmJ
InChI InChI=1S/C14H24O2/c1-4-6-7-8-9-10-11-12-16-14(15)13(3)5-2/h5,9-10H,4,6-8,11-12H2,1-3H3/b10-9-,13-5+
InChIKey PHYVRJBNPCQLHO-RBUNJRTFSA-N
Mol Weight 224.34 g/mol
Molecular Formula C14H24O2
Exact Mass 224.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID bPaZ4fK2Q
Name Nonenyl tiglate, (3Z)-
CAS Registry Number 1231959-65-1
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 224.177630011 u
Formula C14H24O2
InChI InChI=1S/C14H24O2/c1-4-6-7-8-9-10-11-12-16-14(15)13(3)5-2/h5,9-10H,4,6-8,11-12H2,1-3H3/b10-9-,13-5+
InChIKey PHYVRJBNPCQLHO-RBUNJRTFSA-N
Molecular Weight 224.344 g/mol
Number of Peaks 50
RI1 1609
RI2 1286
RI3 1354
RI4 1316
RI5 1596
SMILES C\C(C(=O)OCC\C=C/CCCCC)=C/C
SPLASH splash10-05o0-9000000000-da2ef9c54a7276e32269
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-nonen-1-yl ester, (2E)-
Wiley ID LM_FFNSC3_3428