| SpectraBase Compound ID | Btjsecl5T51 |
|---|---|
| InChI | InChI=1S/C9H7N3/c10-5-8(6-11)7-1-3-9(12)4-2-7/h1-4,8H,12H2 |
| InChIKey | BDUFKRHXTVZQFY-UHFFFAOYSA-N |
| Mol Weight | 157.18 g/mol |
| Molecular Formula | C9H7N3 |
| Exact Mass | 157.063997 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | A969Pawexc |
|---|---|
| Name | |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C9H7N3 |
| InChI | InChI=1S/C9H7N3/c10-5-8(6-11)7-1-3-9(12)4-2-7/h1-4,8H,12H2 |
| InChIKey | BDUFKRHXTVZQFY-UHFFFAOYSA-N |
| Molecular Weight | 157.0639 |
| SMILES | Nc1ccc(C(C#N)C#N)cc1 |
| SPLASH | splash10-0a4i-5900000000-8d02e8dca0e425d831d3 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |