| SpectraBase Spectrum ID |
DoWRUOIiZVo |
| Name |
n-Octyl acetate |
| CAS Registry Number |
112-14-1 |
| Classification |
Flavor, fragrance |
| Comments |
Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
172.146329882 u |
| Formula |
C10H20O2 |
| InChI |
InChI=1S/C10H20O2/c1-3-4-5-6-7-8-9-12-10(2)11/h3-9H2,1-2H3 |
| InChIKey |
YLYBTZIQSIBWLI-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
172.268 g/mol |
| Nominal Mass |
172 u |
| Quality |
1000 |
| Retention Index |
1190 |
| SMILES |
C(OCCCCCCCC)(=O)C |
| SPLASH |
splash10-0006-9000000000-b0c3aabe6b5e63624b4d |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
octyl acetate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_009694 |
