| SpectraBase Compound ID | GkuSHMBR55N |
|---|---|
| InChI | InChI=1S/C13H16O4S/c1-4-17-9-13(11(3)14)18(15,16)12-7-5-10(2)6-8-12/h5-9H,4H2,1-3H3/b13-9+ |
| InChIKey | NMZWQUWJUNAKQC-UKTHLTGXSA-N |
| Mol Weight | 268.33 g/mol |
| Molecular Formula | C13H16O4S |
| Exact Mass | 268.07693 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | F5B3P1MM8VN |
|---|---|
| Name | 4-Ethoxy-3-(tosyl)but-3-en-2-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H16O4S |
| InChI | InChI=1S/C13H16O4S/c1-4-17-9-13(11(3)14)18(15,16)12-7-5-10(2)6-8-12/h5-9H,4H2,1-3H3/b13-9+ |
| InChIKey | NMZWQUWJUNAKQC-UKTHLTGXSA-N |
| Molecular Weight | 268.327 g/mol |
| SMILES | C(\C(S(c1ccc(cc1)C)(=O)=O)=C/OCC)(=O)C |
| SPLASH | splash10-00kg-9510000000-48e9b2954441eb0507d5 |
| Source of Spectrum | F4-41-2227-2b |
| Wiley ID | 1672606 |