| SpectraBase Compound ID | 1Z19bVUExpS |
|---|---|
| InChI | InChI=1S/C13H10INO4S/c14-12-8-4-5-10(13(12)15(16)17)9-20(18,19)11-6-2-1-3-7-11/h1-8H,9H2 |
| InChIKey | ZSYMLDOPXVLSHG-UHFFFAOYSA-N |
| Mol Weight | 403.19 g/mol |
| Molecular Formula | C13H10INO4S |
| Exact Mass | 402.937524 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Enu9GkgWYnw |
|---|---|
| Name | (2-Nitro-3-iodobenzyl) Phenyl Sulfone |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H10INO4S |
| InChI | InChI=1S/C13H10INO4S/c14-12-8-4-5-10(13(12)15(16)17)9-20(18,19)11-6-2-1-3-7-11/h1-8H,9H2 |
| InChIKey | ZSYMLDOPXVLSHG-UHFFFAOYSA-N |
| Molecular Weight | 403.190 g/mol |
| SMILES | C(S(=O)(=O)c1ccccc1)c1c(N(=O)=O)c(I)ccc1 |
| SPLASH | splash10-03fr-4091000000-c5ec85c8847d9998f188 |
| Source of Spectrum | QE-14-11121-D |
| Wiley ID | 1692503 |