| SpectraBase Compound ID | 5r2wU1cdEO5 |
|---|---|
| InChI | InChI=1S/C11H13ClO2S/c1-9-3-5-11(6-4-9)15(13,14)8-10(2)7-12/h3-6H,2,7-8H2,1H3/i8D2 |
| InChIKey | LFPWGJKPYPSAEB-MGVXTIMCSA-N |
| Mol Weight | 246.75 g/mol |
| Molecular Formula | C11H11D2ClO2S |
| Exact Mass | 246.045032 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 6Wp3Ldsd6ip |
|---|---|
| Name | 2-(Chloromethyl)-3,3-dideuterio-3-tosyl-1-propene |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C11H11D2ClO2S |
| InChI | InChI=1S/C11H13ClO2S/c1-9-3-5-11(6-4-9)15(13,14)8-10(2)7-12/h3-6H,2,7-8H2,1H3/i8D2 |
| InChIKey | LFPWGJKPYPSAEB-MGVXTIMCSA-N |
| Molecular Weight | 246.748 g/mol |
| SMILES | C(S(c1ccc(cc1)C)(=O)=O)(C(=C)CCl)([D])[D] |
| SPLASH | splash10-0a4i-5940000000-e1e99dd365c791bc0522 |
| Source of Spectrum | F-50-3499-3 |
| Wiley ID | 1246628 |