| SpectraBase Compound ID | KRQVRgDl4bc |
|---|---|
| InChI | InChI=1S/C9H6N2/c10-4-8-6-1-2-7(3-6)9(8)5-11/h1-2,6-7H,3H2/t6-,7+ |
| InChIKey | XKDBHCJBKRLHRJ-KNVOCYPGSA-N |
| Mol Weight | 142.16 g/mol |
| Molecular Formula | C9H6N2 |
| Exact Mass | 142.053098 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | J6bNEVsSiXt |
|---|---|
| Name | |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C9H6N2 |
| InChI | InChI=1S/C9H6N2/c10-4-8-6-1-2-7(3-6)9(8)5-11/h1-2,6-7H,3H2/t6-,7+ |
| InChIKey | XKDBHCJBKRLHRJ-KNVOCYPGSA-N |
| Molecular Weight | 142.0530 |
| SMILES | C1=C[C@]2(C[C@@]1(C(=C2C#N)C#N)[H])[H] |
| SPLASH | splash10-014i-9600000000-0850d951efc67493b682 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |