| SpectraBase Compound ID | ImZmXazZtyH |
|---|---|
| InChI | InChI=1S/C8H7N/c9-7-6-8-4-2-1-3-5-8/h1-5H,6H2/i6+1 |
| InChIKey | SUSQOBVLVYHIEX-PTQBSOBMSA-N |
| Mol Weight | 118.14 g/mol |
| Molecular Formula | C713CH7N |
| Exact Mass | 118.061204 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | I8iMeBW01pc |
|---|---|
| Name | 2-Phenylacetonitrile |
| Alternate Name(s) | 2-Phenylethanenitrile |
| Comments | Original formula: C7[13C]H7N |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H7N |
| InChI | InChI=1S/C8H7N/c9-7-6-8-4-2-1-3-5-8/h1-5H,6H2/i6+1 |
| InChIKey | SUSQOBVLVYHIEX-PTQBSOBMSA-N |
| Molecular Weight | 118.143 g/mol |
| SMILES | [13CH2](C#N)c1ccccc1 |
| SPLASH | splash10-014i-8900000000-21722a883848571d9147 |
| Source of Spectrum | OS-5-250-0 |
| Wiley ID | 80765 |