| SpectraBase Spectrum ID |
3sPhqoXUs89 |
| Name |
3-Cyanomethyl-5-methylphthalide |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H9NO2 |
| InChI |
InChI=1S/C11H9NO2/c1-7-2-3-8-9(6-7)10(4-5-12)14-11(8)13/h2-3,6,10H,4H2,1H3 |
| InChIKey |
NDTNDOVTYZUATJ-UHFFFAOYSA-N |
| Literature Reference DOI |
10.1021/ol201563r |
| Molecular Weight |
187.198 g/mol |
| SMILES |
c1cc(cc2C(OC(c12)=O)CC#N)C |
| SPLASH |
splash10-0005-5900000000-951086fa91df2da1789e |
| Source of Spectrum |
A1-13-4153/SMS12-3jc |
| Synonyms |
2-(6-Methyl-3-oxo-1,3-dihydroisobenzofuran-1-yl)acetonitrile |
| Wiley ID |
1753580 |
