| SpectraBase Spectrum ID |
70U4sDDQiHD |
| Name |
Linalool isobutyrate |
| CAS Registry Number |
78-35-3 |
| 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 |
224.177630011 u |
| Formula |
C14H24O2 |
| InChI |
InChI=1S/C14H24O2/c1-7-14(6,10-8-9-11(2)3)16-13(15)12(4)5/h7,9,12H,1,8,10H2,2-6H3 |
| InChIKey |
JZIARAQCPRDGAC-UHFFFAOYSA-N |
| Molecular Weight |
224.344 g/mol |
| Number of Peaks |
50 |
| RI1 |
1366 |
| RI2 |
1044 |
| RI3 |
1017 |
| RI4 |
973 |
| SMILES |
C(CCC=C(C)C)(C)(C=C)OC(C(C)C)=O |
| SPLASH |
splash10-0006-9000000000-7b5dd144a29dc3f58e0b |
| 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 |
Propanoic acid, 2-methyl-, 1-ethenyl-1,5-dimethyl-4-hexenyl ester |
| Wiley ID |
LM_FFNSC3_1267 |
