| SpectraBase Spectrum ID |
8F3ekX90zTM |
| Name |
Isobutyl 4-ethylbenzoate |
| Classification |
Chemical |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
206.130679818 u |
| Formula |
C13H18O2 |
| InChI |
InChI=1S/C13H18O2/c1-4-11-5-7-12(8-6-11)13(14)15-9-10(2)3/h5-8,10H,4,9H2,1-3H3 |
| InChIKey |
SOHLMERTGKOOKX-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
206.285 g/mol |
| Nominal Mass |
206 u |
| Quality |
976 |
| Retention Index |
1557 |
| SMILES |
C1(C(OCC(C)C)=O)=CC=C(C=C1)CC |
| SPLASH |
splash10-0f89-3900000000-c96b2f8c64d287893aff |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
4-Ethylbenzoic acid isobutyl ester |
| Technique |
GC/MS |
| Wiley ID |
DD2024_022417 |
