| SpectraBase Spectrum ID |
J51AJVSb8xi |
| Name |
Methyl 3-(s-butyl)benzoate |
| Appearance |
Yellow oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H16O2 |
| InChI |
InChI=1S/C12H16O2/c1-4-9(2)10-6-5-7-11(8-10)12(13)14-3/h5-9H,4H2,1-3H3 |
| InChIKey |
PCJVISLCVPHMKH-UHFFFAOYSA-N |
| Instrument Name |
HP 5995C |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.202101571 |
| Molecular Weight |
192.258 g/mol |
| Reported Formula |
C12H16O2 |
| SMILES |
C(CC)(C)c1cc(ccc1)C(OC)=O |
| SPLASH |
splash10-03di-0900000000-e02a2c50cda053ffff7c |
| Source of Spectrum |
ACI-60-SM21-46 |
| Wiley ID |
1880355 |
