| SpectraBase Spectrum ID |
JIvTnK0vUXI |
| Name |
Octanoic acid |
| CAS Registry Number |
124-07-2 |
| Classification |
Chemical |
| Comments |
Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
144.115029753 u |
| Formula |
C8H16O2 |
| InChI |
InChI=1S/C8H16O2/c1-2-3-4-5-6-7-8(9)10/h2-7H2,1H3,(H,9,10) |
| InChIKey |
WWZKQHOCKIZLMA-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
144.214 g/mol |
| Nominal Mass |
144 u |
| Quality |
986 |
| Retention Index |
990 |
| SMILES |
OC(CCCCCCC)=O |
| SPLASH |
splash10-03kc-9000000000-b4715ccd7301457fac26 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Caprylic acid |
| Technique |
GC/MS |
| Wiley ID |
DD2024_033159 |
