| SpectraBase Spectrum ID |
DkYPNFvY6XA |
| Name |
Isopropyl 4-butylbenzoate |
| Classification |
Chemical |
| Copyright |
Copyright © 2024-2025 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
220.146329882 u |
| Formula |
C14H20O2 |
| InChI |
InChI=1S/C14H20O2/c1-4-5-6-12-7-9-13(10-8-12)14(15)16-11(2)3/h7-11H,4-6H2,1-3H3 |
| InChIKey |
OQTSQTBIPUQSPV-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
220.312 g/mol |
| Nominal Mass |
220 u |
| Quality |
999 |
| Retention Index |
1596 |
| SMILES |
C=1(C(OC(C)C)=O)C=CC(=CC1)CCCC |
| SPLASH |
splash10-03du-4910000000-8ada4a904b337a3918e9 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Benzoic acid,4-butyl-,isopropyl ester |
| Technique |
GC/MS |
| Wiley ID |
DD2024_022407 |
