| SpectraBase Compound ID | ERwPhmW1Qjf |
|---|---|
| InChI | InChI=1S/C11H14O3S/c1-10-4-6-11(7-5-10)15(13,14)9-3-2-8-12/h3-7,9,12H,2,8H2,1H3/b9-3+/i9D |
| InChIKey | TVDIKSRONUXLML-NOIRHLGBSA-N |
| Mol Weight | 227.3 g/mol |
| Molecular Formula | C11H132DO3S |
| Exact Mass | 227.072642 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 4jYQFdJhbCy |
|---|---|
| Name | (E)-4-Deuterio-4-tosyl-3-buten-1-ol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C11H13DO3S |
| InChI | InChI=1S/C11H14O3S/c1-10-4-6-11(7-5-10)15(13,14)9-3-2-8-12/h3-7,9,12H,2,8H2,1H3/b9-3+/i9D |
| InChIKey | TVDIKSRONUXLML-NOIRHLGBSA-N |
| Molecular Weight | 227.296 g/mol |
| SMILES | OCC\C=C\(S(=O)(=O)c1ccc(C)cc1)[2D] |
| SPLASH | splash10-000g-6900000000-d5048455db40dbfed2bb |
| Source of Spectrum | F-53-11456-4 |
| Wiley ID | 803503 |