| SpectraBase Spectrum ID |
ASH6HHu2Gzw |
| Name |
Benzeneacetonitrile, ar-acetyl-ar-cyano-ar-hydroxy-ar-methyl- |
| Alternate Name(s) |
1-Hydroxy-2-cyano-3-methyl-5-(nitrimethyl)-6-acetyl-benzene
3-Acetyl-4-(cyanomethyl)-2-hydroxy-6-methylbenzonitrile |
| CAS Registry Number |
115706-59-7 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H10N2O2 |
| InChI |
InChI=1S/C12H10N2O2/c1-7-5-9(3-4-13)11(8(2)15)12(16)10(7)6-14/h5,16H,3H2,1-2H3 |
| InChIKey |
LXWLLKCEUWMBQF-UHFFFAOYSA-N |
| Molecular Weight |
214.224 g/mol |
| SMILES |
Oc1c(c(CC#N)cc(c1C#N)C)C(=O)C |
| SPLASH |
splash10-0002-2930000000-c82a0fbeefe9e1ca9eed |
| Source of Spectrum |
C-110-6184-19 |
| Wiley ID |
1213522 |
