| SpectraBase Spectrum ID |
8JhyKJN2axc |
| Name |
2-Methylpropylbutanoate |
| CAS Registry Number |
539-90-2 |
| 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/c1-4-5-8(9)10-6-7(2)3/h7H,4-6H2,1-3H3 |
| InChIKey |
RGFNRWTWDWVHDD-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
144.214 g/mol |
| Nominal Mass |
144 u |
| Quality |
964 |
| Retention Index |
990 |
| SMILES |
C(OCC(C)C)(CCC)=O |
| SPLASH |
splash10-05fu-9000000000-28b3f804b4210073b1a4 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
n-Propyl 2-methyl butyrate
Propyl 2-methylbutanoate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_027649 |
