| SpectraBase Spectrum ID |
JGf71qKG3Si |
| Name |
Ethylcaprylate |
| CAS Registry Number |
106-32-1 |
| Classification |
Chemical |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found) |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
172.146329882 u |
| Formula |
C10H20O2 |
| InChI |
InChI=1S/C10H20O2/c1-3-5-6-7-8-9-10(11)12-4-2/h3-9H2,1-2H3 |
| InChIKey |
YYZUSRORWSJGET-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
172.268 g/mol |
| Nominal Mass |
172 u |
| Quality |
990 |
| Retention Index |
1190 |
| SMILES |
C(CCCCCCC)(OCC)=O |
| SPLASH |
splash10-059i-9200000000-20555d420e2d800adfb5 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Ethyl octanoate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_030730 |
