| SpectraBase Spectrum ID |
IQrXsXpBSYM |
| Name |
Isobutyl 4-propyl benzoate |
| Classification |
Chemical |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
220.146329882 u |
| Formula |
C14H20O2 |
| InChI |
InChI=1S/C14H20O2/c1-4-5-12-6-8-13(9-7-12)14(15)16-10-11(2)3/h6-9,11H,4-5,10H2,1-3H3 |
| InChIKey |
TWZBKXOKRZXPOC-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
220.312 g/mol |
| Nominal Mass |
220 u |
| Quality |
972 |
| Retention Index |
1651 |
| SMILES |
C=1(C(OCC(C)C)=O)C=CC(=CC1)CCC |
| SPLASH |
splash10-00kb-4900000000-83043ada396b948fb3e0 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Isobutyl-4-propylbenzoate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_022655 |
