| SpectraBase Compound ID | 4FiIjZGSGJc |
|---|---|
| InChI | InChI=1S/C9H5N3O2/c10-5-8(6-11)7-1-3-9(4-2-7)12(13)14/h1-4,8H |
| InChIKey | HXEPLLFRQAVQQJ-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 | CWGTQJbB1Gn |
|---|---|
| Name | |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C9H5N3O2 |
| InChI | InChI=1S/C9H5N3O2/c10-5-8(6-11)7-1-3-9(4-2-7)12(13)14/h1-4,8H |
| InChIKey | HXEPLLFRQAVQQJ-UHFFFAOYSA-N |
| Molecular Weight | 187.0381 |
| SMILES | c1(N(=O)=O)ccc(C(C#N)C#N)cc1 |
| SPLASH | splash10-014i-6900000000-069d13914c3317f654d9 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |