| SpectraBase Spectrum ID |
GWN6pXo3nEm |
| Name |
Hexyl valerate |
| CAS Registry Number |
1117-59-5 |
| Classification |
Chemical |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
186.161979946 u |
| Formula |
C11H22O2 |
| InChI |
InChI=1S/C11H22O2/c1-3-5-7-8-10-13-11(12)9-6-4-2/h3-10H2,1-2H3 |
| InChIKey |
YERFHJZYNMRVLO-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
186.295 g/mol |
| Nominal Mass |
186 u |
| Quality |
997 |
| Retention Index |
1303 |
| SMILES |
C(OCCCCCC)(CCCC)=O |
| SPLASH |
splash10-0pdu-9100000000-afcdbe59597c6a5c665f |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Valeric acid hexyl ester
Hexyl pentanoate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_022151 |
