| SpectraBase Spectrum ID |
BbCeyd87OhH |
| Name |
Decenoate |
| CAS Registry Number |
76649-16-6 |
| 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 |
198.161979946 u |
| Formula |
C12H22O2 |
| InChI |
InChI=1S/C12H22O2/c1-3-5-6-7-8-9-10-11-12(13)14-4-2/h8-9H,3-7,10-11H2,1-2H3/b9-8+ |
| InChIKey |
AWNIQMQADACLCJ-CMDGGOBGSA-N |
| Molecular Weight |
198.306 g/mol |
| Number of Peaks |
50 |
| RI1 |
1380 |
| RI2 |
1059 |
| RI3 |
1068 |
| RI4 |
1025 |
| SMILES |
C(\C=C\CCC(OCC)=O)CCCC |
| SPLASH |
splash10-07vu-9200000000-ec656a73466c1696abbf |
| 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 |
4-Decenoic acid, ethyl ester, (4E)- |
| Wiley ID |
LM_FFNSC3_1362 |
