| SpectraBase Compound ID | 4HMks8yqp4H |
|---|---|
| InChI | InChI=1S/C9H5N3O2/c10-3-6-1-8(12(13)14)2-7-4-11-5-9(6)7/h1-2,4-5,11H |
| InChIKey | ZHYGAFLXUWVXQL-UHFFFAOYSA-N |
| Mol Weight | 187.16 g/mol |
| Molecular Formula | C9H5N3O2 |
| Exact Mass | 187.038176 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | FsQmtFgdX3k |
|---|---|
| Name | 6-Nitro-2H-isoindole-4-carbonitrile |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H5N3O2 |
| InChI | InChI=1S/C9H5N3O2/c10-3-6-1-8(12(13)14)2-7-4-11-5-9(6)7/h1-2,4-5,11H |
| InChIKey | ZHYGAFLXUWVXQL-UHFFFAOYSA-N |
| Molecular Weight | 187.158 g/mol |
| SMILES | [nH]1cc2c(cc(cc2c1)N(=O)=O)C#N |
| SPLASH | splash10-000l-0900000000-675b304691bb9bbfec36 |
| Source of Spectrum | KC-0-998-6 |
| Wiley ID | 830305 |