| SpectraBase Spectrum ID |
K3aG3DIPeWt |
| Name |
3-Cyanomethylphthalide |
| Alternate Name(s) |
2-(3-oxo-1,3-dihydroisobenzofuran-1-yl)acetonitrile
2-(3-oxo-1H-2-benzofuran-1-yl)acetonitrile
2-(3-oxo-1H-isobenzofuran-1-yl)acetonitrile
2-(3-oxidanylidene-1H-2-benzofuran-1-yl)ethanenitrile |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C10H7NO2 |
| InChI |
InChI=1S/C10H7NO2/c11-6-5-9-7-3-1-2-4-8(7)10(12)13-9/h1-4,9H,5H2 |
| InChIKey |
LGLLUFNSKWOZQQ-UHFFFAOYSA-N |
| Literature Reference DOI |
10.1021/ol201563r |
| Molecular Weight |
173.171 g/mol |
| SMILES |
c1cccc2C(OC(c12)=O)CC#N |
| SPLASH |
splash10-001i-2900000000-d6d8fb7c84b57778c337 |
| Source of Spectrum |
A1-13-4153/SMS12-3lc |
| Wiley ID |
1753583 |
