| SpectraBase Spectrum ID |
2o3g35hlAtk |
| Name |
Butyl valerate |
| CAS Registry Number |
591-68-4 |
| Classification |
Chemical |
| Copyright |
Copyright © 2024-2025 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
158.130679818 u |
| Formula |
C9H18O2 |
| InChI |
InChI=1S/C9H18O2/c1-3-5-7-9(10)11-8-6-4-2/h3-8H2,1-2H3 |
| InChIKey |
OKJADYKTJJGKDX-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
158.241 g/mol |
| Nominal Mass |
158 u |
| Quality |
996 |
| Retention Index |
1089 |
| SMILES |
C(OCCCC)(CCCC)=O |
| SPLASH |
splash10-0a70-9100000000-509858ec4869b37e4f2b |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Valeric acid butyl ester
Butyl pentanoate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_022149 |
