| SpectraBase Spectrum ID |
FyxAYXP7RVk |
| Name |
Isovalerate |
| Source of Sample |
SAFC Cat.no. W215201 |
| CAS Registry Number |
103-38-8 |
| Copyright |
Database Compilation Copyright © 2023-2025 John Wiley and Sons, Inc. Copyright © 2023-2025 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
192.115029753 u |
| Formula |
C12H16O2 |
| InChI |
InChI=1S/C12H16O2/c1-10(2)8-12(13)14-9-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3 |
| InChIKey |
HVJKZICIMIWFCP-UHFFFAOYSA-N |
| Molecular Weight |
192.258 g/mol |
| Number of Peaks |
50 |
| RI1 |
1399 |
| RI2 |
1078 |
| RI3 |
1274 |
| RI4 |
1232 |
| SMILES |
c1cccc(c1)COC(CC(C)C)=O |
| SPLASH |
splash10-052f-9300000000-5d6bfc3600346ef3ec1b |
| 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, 3-methyl-, phenylmethyl ester |
| Wiley ID |
LM_FFNSC3_290 |
