| SpectraBase Compound ID | 9TXuCcPIVTP |
|---|---|
| InChI | InChI=1S/C13H14BrIO2/c14-10-6-2-4-8-12(10)17-13(16)9-5-1-3-7-11(9)15/h1,3,5,7,10,12H,2,4,6,8H2 |
| InChIKey | FIWDJVSURYQNDV-UHFFFAOYSA-N |
| Mol Weight | 409.06 g/mol |
| Molecular Formula | C13H14BrIO2 |
| Exact Mass | 407.922188 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | C10X5gfpVhj |
|---|---|
| Name | 2-Bromocyclohexyl-2-iodobenzoate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H14BrIO2 |
| InChI | InChI=1S/C13H14BrIO2/c14-10-6-2-4-8-12(10)17-13(16)9-5-1-3-7-11(9)15/h1,3,5,7,10,12H,2,4,6,8H2 |
| InChIKey | FIWDJVSURYQNDV-UHFFFAOYSA-N |
| Molecular Weight | 409.061 g/mol |
| SMILES | C(c1c(cccc1)I)(=O)OC1C(CCCC1)Br |
| SPLASH | splash10-001i-2090000000-29a08e151463caec171d |
| Source of Spectrum | C5-2005-439-0 |
| Wiley ID | 1617982 |