| SpectraBase Spectrum ID |
9ua61B9Rbda |
| Name |
7-cyano-5-nitro-2H-isoindole-1-carboxylic acid tert-butyl ester |
| Alternate Name(s) |
tert-Butyl 7-cyano-5-nitro-2H-isoindole-1-carboxylate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H13N3O4 |
| InChI |
InChI=1S/C14H13N3O4/c1-14(2,3)21-13(18)12-11-8(6-15)4-10(17(19)20)5-9(11)7-16-12/h4-5,7,16H,1-3H3 |
| InChIKey |
JJGSMJBHHGLRAR-UHFFFAOYSA-N |
| Molecular Weight |
287.275 g/mol |
| SMILES |
[nH]1cc2c(c1C(OC(C)(C)C)=O)c(cc(c2)N(=O)=O)C#N |
| SPLASH |
splash10-01q9-0190000000-88fe0ca49de59628eb28 |
| Source of Spectrum |
KC-0-998-2 |
| Wiley ID |
830308 |
