| SpectraBase Spectrum ID |
GU7262P0mA4 |
| Name |
Butanoic acid 1-methylpropyl ester |
| CAS Registry Number |
819-97-6 |
| Classification |
Chemical |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
144.115029753 u |
| Formula |
C8H16O2 |
| InChI |
InChI=1S/C8H16O2/c1-4-6-8(9)10-7(3)5-2/h7H,4-6H2,1-3H3 |
| InChIKey |
QJHDFBAAFGELLO-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
144.214 g/mol |
| Nominal Mass |
144 u |
| Quality |
1000 |
| Retention Index |
990 |
| SMILES |
C(OC(CC)C)(CCC)=O |
| SPLASH |
splash10-0abl-9000000000-afb166cf231d5bdff45a |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
butan-2-yl butanoate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_035083 |
