| SpectraBase Compound ID | GESzE2zgbrg |
|---|---|
| InChI | InChI=1S/C4H4I3N/c5-2-1-4(6,7)3-8/h1-2H2 |
| InChIKey | NMFXVADCHOWAMA-UHFFFAOYSA-N |
| Mol Weight | 446.8 g/mol |
| Molecular Formula | C4H4I3N |
| Exact Mass | 446.747784 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | JsgUiFW42cu |
|---|---|
| Name | 1,3,3-Triiodo-3-cyanopropane |
| Alternate Name(s) | 2,2,4-Triiodobutanenitrile |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C4H4I3N |
| InChI | InChI=1S/C4H4I3N/c5-2-1-4(6,7)3-8/h1-2H2 |
| InChIKey | NMFXVADCHOWAMA-UHFFFAOYSA-N |
| Molecular Weight | 446.796 g/mol |
| SMILES | C(CC(C#N)(I)I)I |
| SPLASH | splash10-0g29-5943200000-e0602d546134cd6a3e0d |
| Source of Spectrum | F9-1985-2285-0 |
| Wiley ID | 1565600 |