| SpectraBase Compound ID | I3ChiC7W7SG |
|---|---|
| InChI | InChI=1S/C12H16FI/c1-12(2,3)10-6-4-9(5-7-10)11(13)8-14/h4-7,11H,8H2,1-3H3 |
| InChIKey | KHFJMIPRNBCBGJ-UHFFFAOYSA-N |
| Mol Weight | 306.16 g/mol |
| Molecular Formula | C12H16FI |
| Exact Mass | 306.028074 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | JPzZtIEIFxc |
|---|---|
| Name | 1-tert-Butyl-4-(1-fluoro-2-iodoethyl)benzene |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H16FI |
| InChI | InChI=1S/C12H16FI/c1-12(2,3)10-6-4-9(5-7-10)11(13)8-14/h4-7,11H,8H2,1-3H3 |
| InChIKey | KHFJMIPRNBCBGJ-UHFFFAOYSA-N |
| Molecular Weight | 306.163 g/mol |
| SMILES | c1(ccc(cc1)C(CI)F)C(C)(C)C |
| SPLASH | splash10-0a6r-9610000000-4a28a82c7515d040cc80 |
| Source of Spectrum | AT-47-276-3 |
| Wiley ID | 1639625 |