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Tiglate <hexyl->
SpectraBase Compound ID CGVYfFs2iCi
InChI InChI=1S/C11H20O2/c1-4-6-7-8-9-13-11(12)10(3)5-2/h5H,4,6-9H2,1-3H3/b10-5+
InChIKey JTCIUOKKVACNCK-BJMVGYQFSA-N
Mol Weight 184.28 g/mol
Molecular Formula C11H20O2
Exact Mass 184.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E64SSP9b0qX
Name Tiglate
Source of Sample SAFC Cat.no. W500909
CAS Registry Number 16930-96-4
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 184.146329882 u
Formula C11H20O2
InChI InChI=1S/C11H20O2/c1-4-6-7-8-9-13-11(12)10(3)5-2/h5H,4,6-9H2,1-3H3/b10-5+
InChIKey JTCIUOKKVACNCK-BJMVGYQFSA-N
Molecular Weight 184.279 g/mol
Number of Peaks 50
RI1 1329
RI2 1006
RI3 1024
RI4 982
RI5 1317
SMILES CCCCCCOC(\C(=C\C)C)=O
SPLASH splash10-0zgl-9400000000-32c9b3db72586f03e778
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-, hexyl ester, (2E)-
Wiley ID LM_FFNSC3_460