| SpectraBase Spectrum ID |
5Wmx6ocwE2e |
| Name |
Isobutyrate <3-phenylpropyl-> |
| Source of Sample |
SAFC Cat.no. W289302 |
| CAS Registry Number |
103-58-2 |
| 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 |
206.130679818 u |
| Formula |
C13H18O2 |
| InChI |
InChI=1S/C13H18O2/c1-11(2)13(14)15-10-6-9-12-7-4-3-5-8-12/h3-5,7-8,11H,6,9-10H2,1-2H3 |
| InChIKey |
VBTAKMZSMFMLGT-UHFFFAOYSA-N |
| Molecular Weight |
206.285 g/mol |
| Number of Peaks |
50 |
| RI1 |
1510 |
| RI2 |
1187 |
| SMILES |
c1cccc(c1)CCCOC(C(C)C)=O |
| SPLASH |
splash10-014i-4900000000-cd62d41c79e9398467c4 |
| 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-, 3-phenylpropyl ester |
| Wiley ID |
LM_FFNSC3_845 |
