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Dodecyl tiglate
SpectraBase Compound ID IbMgRy7yGka
InChI InChI=1S/C17H32O2/c1-4-6-7-8-9-10-11-12-13-14-15-19-17(18)16(3)5-2/h5H,4,6-15H2,1-3H3/b16-5+
InChIKey YSACBAGMGGQJJP-FZSIALSZSA-N
Mol Weight 268.4 g/mol
Molecular Formula C17H32O2
Exact Mass 268.24023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5PKSYNRxpRd
Name Dodecyl tiglate
CAS Registry Number 1231959-17-3
Copyright Database Compilation Copyright © 2023-2025 John Wiley and Sons, Inc. Copyright © 2023-2025 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 268.240230268 u
Formula C17H32O2
InChI InChI=1S/C17H32O2/c1-4-6-7-8-9-10-11-12-13-14-15-19-17(18)16(3)5-2/h5H,4,6-15H2,1-3H3/b16-5+
InChIKey YSACBAGMGGQJJP-FZSIALSZSA-N
Molecular Weight 268.441 g/mol
Number of Peaks 50
RI1 1928
RI2 1603
RI3 1627
RI4 1589
RI5 1914
SMILES C\C(C(=O)OCCCCCCCCCCCC)=C/C
SPLASH splash10-0pbc-9200000000-a749844dd5439f180c04
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-, dodecyl ester, (2E)-
Wiley ID LM_FFNSC3_3417