| SpectraBase Compound ID | ASbYMSVaytW |
|---|---|
| InChI | InChI=1S/C6H6IN/c7-5-2-1-3-6(8)4-5/h1-4H,8H2 |
| InChIKey | FFCSRWGYGMRBGD-UHFFFAOYSA-N |
| Mol Weight | 219.03 g/mol |
| Molecular Formula | C6H6IN |
| Exact Mass | 218.954494 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3DNaSBRKMir |
|---|---|
| Name | 3-iodoaniline |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H6IN |
| InChI | InChI=1S/C6H6IN/c7-5-2-1-3-6(8)4-5/h1-4H,8H2 |
| InChIKey | FFCSRWGYGMRBGD-UHFFFAOYSA-N |
| Literature Reference DOI | 10.1002/cssc.201801641 |
| Molecular Weight | 219.025 g/mol |
| SMILES | Nc1cc(ccc1)I |
| SPLASH | splash10-014i-9050000000-3ddcc106dfb09ae2d82d |
| Source of Spectrum | CSC-11-SM21-Table2Entry9 |
| Wiley ID | 1812851 |