| SpectraBase Compound ID | 5cvPF0tijcz |
|---|---|
| InChI | InChI=1S/C7H4IN/c8-7-3-1-6(5-9)2-4-7/h1-4H |
| InChIKey | XOKDXPVXJWTSRM-UHFFFAOYSA-N |
| Mol Weight | 229.02 g/mol |
| Molecular Formula | C7H4IN |
| Exact Mass | 228.938844 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2R3l5qoLYW |
|---|---|
| Name | 4-Iodobenzonitrile |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H4IN |
| InChI | InChI=1S/C7H4IN/c8-7-3-1-6(5-9)2-4-7/h1-4H |
| InChIKey | XOKDXPVXJWTSRM-UHFFFAOYSA-N |
| Instrument Name | Agilent 6890-5973N |
| Ionization Type | EI |
| Literature Reference DOI | 10.1002/asia.202100776 |
| Molecular Weight | 229.020 g/mol |
| SMILES | c1(I)ccc(cc1)C#N |
| SPLASH | splash10-0fb9-7980000000-d4d0d2b688b915838161 |
| Source of Spectrum | CAJ-16-SM27-27-1 |
| Wiley ID | 1866991 |