| SpectraBase Spectrum ID |
FXyVWUZiqFp |
| Name |
Pentylallyl butyrate |
| Source of Sample |
SAFC Cat.no. W361208 |
| CAS Registry Number |
16491-54-6 |
| 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/c1-4-7-8-10-11(6-3)14-12(13)9-5-2/h6,11H,3-5,7-10H2,1-2H3 |
| InChIKey |
LZWFXVJBIZIHCH-UHFFFAOYSA-N |
| Molecular Weight |
198.306 g/mol |
| Number of Peaks |
50 |
| RI1 |
1282 |
| RI2 |
960 |
| RI3 |
928 |
| RI4 |
881 |
| RI5 |
1271 |
| SMILES |
C(OC(CCC)=O)(CCCCC)C=C |
| SPLASH |
splash10-00dl-9000000000-2d512ee44cc05856a9f5 |
| 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 |
Butanoic acid, 1-ethenylhexyl ester |
| Wiley ID |
LM_FFNSC3_644 |
