| SpectraBase Spectrum ID |
JEuPnneNrW4 |
| Name |
3-Pentyl benzoate |
| Classification |
Chemical |
| Copyright |
Copyright © 2024-2025 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
192.115029753 u |
| Formula |
C12H16O2 |
| InChI |
InChI=1S/C12H16O2/c1-3-11(4-2)14-12(13)10-8-6-5-7-9-10/h5-9,11H,3-4H2,1-2H3 |
| InChIKey |
JQTUTXVQBIISHZ-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
192.258 g/mol |
| Nominal Mass |
192 u |
| Quality |
994 |
| Retention Index |
1354 |
| SMILES |
C=1(C(OC(CC)CC)=O)C=CC=CC1 |
| SPLASH |
splash10-0ab9-6900000000-b1c6ad6680aba3023ab6 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1-Ethylpropyl benzoate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_015341 |
