| SpectraBase Compound ID | CbXlKMTytYy |
|---|---|
| InChI | InChI=1S/C12H16ClI/c1-9(2)11(8-14)12(13)10-6-4-3-5-7-10/h3-7,9,11-12H,8H2,1-2H3 |
| InChIKey | XMIBFKOMYKNREN-UHFFFAOYSA-N |
| Mol Weight | 322.62 g/mol |
| Molecular Formula | C12H16ClI |
| Exact Mass | 321.998523 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | EpiFyFhhhMI |
|---|---|
| Name | 1-Chloro-2-iodomethyl-3-methyl-1-phenylbutane |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H16ClI |
| InChI | InChI=1S/C12H16ClI/c1-9(2)11(8-14)12(13)10-6-4-3-5-7-10/h3-7,9,11-12H,8H2,1-2H3 |
| InChIKey | XMIBFKOMYKNREN-UHFFFAOYSA-N |
| Molecular Weight | 322.617 g/mol |
| SMILES | C(C(c1ccccc1)Cl)(C(C)C)CI |
| SPLASH | splash10-004i-1900000000-1f11a3dace69af61d3d1 |
| Source of Spectrum | O1-47-349-9b |
| Wiley ID | 1669595 |