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(2E,6E,9E)-2,6,10-Trimethyl-2,6,9,11-dodecatetraenal
SpectraBase Compound ID 4QfaavQcGLK
InChI InChI=1S/C15H22O/c1-5-13(2)8-6-9-14(3)10-7-11-15(4)12-16/h5,8-9,11-12H,1,6-7,10H2,2-4H3/b13-8+,14-9+,15-11+
InChIKey PFSTYGCNVAVZBK-JQGMZEBDSA-N
Mol Weight 218.34 g/mol
Molecular Formula C15H22O
Exact Mass 218.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4bj8Vx2OcRB
Name Sinensal
CAS Registry Number 17909-77-2
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 218.167065327 u
Formula C15H22O
InChI InChI=1S/C15H22O/c1-5-13(2)8-6-9-14(3)10-7-11-15(4)12-16/h5,8-9,11-12H,1,6-7,10H2,2-4H3/b13-8+,14-9+,15-11+
InChIKey PFSTYGCNVAVZBK-JQGMZEBDSA-N
Molecular Weight 218.340 g/mol
Number of Peaks 50
RI1 1749
RI2 1425
SMILES C(\C(=C\CC\C(=C\C\C=C\(C=C)C)C)C)=O
SPLASH splash10-054o-9300000000-e3a35993dbdac04df1ea
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 2,6,9,11-Dodecatetraenal, 2,6,10-trimethyl-, (2E,6E,9E)-
Wiley ID LM_FFNSC3_1005