| SpectraBase Spectrum ID |
JFew4YgUGQ4 |
| Name |
Methylcaprate |
| CAS Registry Number |
110-42-9 |
| Classification |
Chemical |
| Comments |
Spectrum verified by crosschecking against external libraries (three reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
186.161979946 u |
| Formula |
C11H22O2 |
| InChI |
InChI=1S/C11H22O2/c1-3-4-5-6-7-8-9-10-11(12)13-2/h3-10H2,1-2H3 |
| InChIKey |
YRHYCMZPEVDGFQ-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
186.295 g/mol |
| Nominal Mass |
186 u |
| Quality |
998 |
| Retention Index |
1290 |
| SMILES |
C(CCCCCCCCC)(OC)=O |
| SPLASH |
splash10-00du-9100000000-2df27a59419c4cbde607 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Decanoic acid methyl ester |
| Technique |
GC/MS |
| Wiley ID |
DD2024_031226 |
