| SpectraBase Spectrum ID |
BMlvX5mT99E |
| Name |
Butyl 2-methylbenzoate |
| Classification |
Chemical |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
192.115029753 u |
| Formula |
C12H16O2 |
| InChI |
InChI=1S/C12H16O2/c1-3-4-9-14-12(13)11-8-6-5-7-10(11)2/h5-8H,3-4,9H2,1-2H3 |
| InChIKey |
GALQLODNTKQGFE-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
192.258 g/mol |
| Nominal Mass |
192 u |
| Quality |
900 |
| Retention Index |
1469 |
| SMILES |
C=1(C(=CC=CC1)C)C(OCCCC)=O |
| SPLASH |
splash10-014l-7900000000-2f2d139db073b83e5389 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Benzoic acid,2-methyl,butyl ester
Butyl 2-methyl benzoate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_022439 |
