| SpectraBase Spectrum ID |
IOii2gMlNO3 |
| Name |
2-Methylallyl benzoate |
| CAS Registry Number |
829-53-8 |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H12O2 |
| InChI |
InChI=1S/C11H12O2/c1-9(2)8-13-11(12)10-6-4-3-5-7-10/h3-7H,1,8H2,2H3 |
| InChIKey |
LQLOHAJUXSDIGF-UHFFFAOYSA-N |
| Literature Reference DOI |
10.1021/ol301563g |
| Molecular Weight |
176.215 g/mol |
| SMILES |
c1(ccccc1)C(=O)OCC(=C)C |
| SPLASH |
splash10-0a4i-3900000000-6ee692ef1e10b3432606 |
| Source of Spectrum |
A1-14-3716/SMS12-3v |
| Synonyms |
2-Methylprop-2-enyl benzoate
Benzoic acid 2-methylallyl ester
Benzoic acid 2-methylprop-2-enyl ester |
| Wiley ID |
1750382 |
