| SpectraBase Compound ID | 28XcApncLV2 |
|---|---|
| InChI | InChI=1S/C8H11BrS/c1-5(2)8-7(9)4-6(3)10-8/h4-5H,1-3H3/i3D3 |
| InChIKey | SUMSFJTXIXDQTC-HPRDVNIFSA-N |
| Mol Weight | 222.16 g/mol |
| Molecular Formula | C8H8D3BrS |
| Exact Mass | 220.995315 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 8lwDEqnPC1E |
|---|---|
| Name | 3-Bromo-2-isopropyl-5-trideuteriomethylthiophene |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H8D3BrS |
| InChI | InChI=1S/C8H11BrS/c1-5(2)8-7(9)4-6(3)10-8/h4-5H,1-3H3/i3D3 |
| InChIKey | SUMSFJTXIXDQTC-HPRDVNIFSA-N |
| Molecular Weight | 222.158 g/mol |
| SMILES | c1(c(cc(s1)C([D])([D])[D])Br)C(C)C |
| SPLASH | splash10-0a4i-0190000000-e9e56eab32c74aeadd83 |
| Source of Spectrum | F-54-1832-22 |
| Wiley ID | 805848 |