| SpectraBase Spectrum ID |
6iwlL7KX28X |
| Name |
Isovalerate |
| Source of Sample |
SAFC Cat.no. W235504 |
| CAS Registry Number |
7774-44-9 |
| 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 |
184.146329882 u |
| Formula |
C11H20O2 |
| InChI |
InChI=1S/C11H20O2/c1-9(2)8-11(12)13-10-6-4-3-5-7-10/h9-10H,3-8H2,1-2H3 |
| InChIKey |
SQPOKBBCNZIWFI-UHFFFAOYSA-N |
| Molecular Weight |
184.279 g/mol |
| Number of Peaks |
50 |
| RI1 |
1279 |
| RI2 |
957 |
| RI3 |
462 |
| RI4 |
423 |
| RI5 |
1261 |
| SMILES |
C(CC(C)C)(=O)OC1CCCCC1 |
| SPLASH |
splash10-0pwl-9200000000-a77b7d6f961335563101 |
| 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-, cyclohexyl ester |
| Wiley ID |
LM_FFNSC3_166 |
