| SpectraBase Compound ID | 9lyCp7CyhcL |
|---|---|
| InChI | InChI=1S/C7H5N/c8-6-7-4-2-1-3-5-7/h1-5H/i1D |
| InChIKey | JFDZBHWFFUWGJE-MICDWDOJSA-N |
| Mol Weight | 104.13 g/mol |
| Molecular Formula | C7H4DN |
| Exact Mass | 104.048476 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | JfWTE5jWWY8 |
|---|---|
| Name | 4-Deuteriobenzonitrile |
| Alternate Name(s) | Benzonitrile-4-D |
| CAS Registry Number | 13122-35-5 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H4DN |
| InChI | InChI=1S/C7H5N/c8-6-7-4-2-1-3-5-7/h1-5H/i1D |
| InChIKey | JFDZBHWFFUWGJE-MICDWDOJSA-N |
| Molecular Weight | 104.130 g/mol |
| SMILES | C(#N)c1ccc(cc1)[D] |
| SPLASH | splash10-0udi-9700000000-d79c920b1cf4d1bb7606 |
| Source of Spectrum | F4-44-191-3i |
| Wiley ID | 1706693 |