| SpectraBase Spectrum ID |
AD2HDegCBeX |
| Name |
2-(3,5-ditert-butyl-4-hydroxy-phenyl)-5-nitro-benzonitrile |
| Alternate Name(s) |
2-(3,5-ditert-butyl-4-oxidanyl-phenyl)-5-nitro-benzenecarbonitrile |
| CAS Registry Number |
97211-19-3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H24N2O3 |
| InChI |
InChI=1S/C21H24N2O3/c1-20(2,3)17-10-13(11-18(19(17)24)21(4,5)6)16-8-7-15(23(25)26)9-14(16)12-22/h7-11,24H,1-6H3 |
| InChIKey |
XHGUWFNJJGCUAJ-UHFFFAOYSA-N |
| Molecular Weight |
352.434 g/mol |
| SMILES |
Oc1c(cc(-c2ccc(N(=O)=O)cc2C#N)cc1C(C)(C)C)C(C)(C)C |
| SPLASH |
splash10-0a4r-8009000000-bf181094666fc510cf4e |
| Source of Spectrum |
J-50-3094-9 |
| Wiley ID |
1343450 |
