| SpectraBase Compound ID | IIvwXzLRDGz |
|---|---|
| InChI | InChI=1S/C8H7N/c9-7-6-8-4-2-1-3-5-8/h1-5H,6H2 |
| InChIKey | SUSQOBVLVYHIEX-UHFFFAOYSA-N |
| Mol Weight | 117.15 g/mol |
| Molecular Formula | C8H7N |
| Exact Mass | 117.057849 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2bgjYMcC1Bk |
|---|---|
| Name | PHENYLACETONITRILE |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C8H7N |
| InChI | InChI=1S/C8H7N/c9-7-6-8-4-2-1-3-5-8/h1-5H,6H2 |
| InChIKey | SUSQOBVLVYHIEX-UHFFFAOYSA-N |
| Molecular Weight | 117.0577 |
| SMILES | c1cccc(CC#N)c1 |
| SPLASH | splash10-014l-9400000000-9e788db8b534e8232e21 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |