| SpectraBase Spectrum ID |
J6xCjT0A1yB |
| Name |
Hexenyl capronate <(2Z)-> |
| CAS Registry Number |
56922-79-3 |
| 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/c1-3-5-7-9-11-14-12(13)10-8-6-4-2/h7,9H,3-6,8,10-11H2,1-2H3/b9-7- |
| InChIKey |
UQPLEMTXCSYMEK-CLFYSBASSA-N |
| Molecular Weight |
198.306 g/mol |
| Number of Peaks |
50 |
| RI1 |
1381 |
| SMILES |
CCC\C=C/COC(CCCCC)=O |
| SPLASH |
splash10-0005-9000000000-f09201c87aa6ae65d73f |
| 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 |
1-Butanol, 2-methyl-, 1-acetate |
| Wiley ID |
LM_FFNSC3_2437 |
