| SpectraBase Compound ID | EMfrYI1Mj3T |
|---|---|
| InChI | InChI=1S/C7H12ClI/c8-7-4-2-1-3-6(7)5-9/h6-7H,1-5H2/t6-,7+/m0/s1 |
| InChIKey | QSVCCKFWAIDKCB-NKWVEPMBSA-N |
| Mol Weight | 258.53 g/mol |
| Molecular Formula | C7H12ClI |
| Exact Mass | 257.967223 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 4qYQ9r6gZxn |
|---|---|
| Name | 1-Chloro-2-iodomethylcyclohexane |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H12ClI |
| InChI | InChI=1S/C7H12ClI/c8-7-4-2-1-3-6(7)5-9/h6-7H,1-5H2/t6-,7+/m0/s1 |
| InChIKey | QSVCCKFWAIDKCB-NKWVEPMBSA-N |
| Molecular Weight | 258.530 g/mol |
| SMILES | [C@]1([C@](Cl)(CCCC1)[H])(CI)[H] |
| SPLASH | splash10-0002-9020000000-0454e283fad267437930 |
| Source of Spectrum | O1-47-353-28 |
| Wiley ID | 1669674 |