SpectraBase Spectrum ID |
4bj8Vx2OcRB |
Name |
Sinensal |
CAS Registry Number |
17909-77-2 |
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 |
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 |