| SpectraBase Compound ID | HQleDqoNGfj |
|---|---|
| InChI | InChI=1S/C13H17NO4S/c1-19-8-7-11(12(15)16)14-13(17)18-9-10-5-3-2-4-6-10/h2-6,11H,7-9H2,1H3,(H,14,17)(H,15,16) |
| InChIKey | FPKHNNQXKZMOJJ-UHFFFAOYSA-N |
| Mol Weight | 283.34 g/mol |
| Molecular Formula | C13H17NO4S |
| Exact Mass | 283.087829 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | GTwxGrYRqUc |
|---|---|
| Name | |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C13H17NO4S |
| InChI | InChI=1S/C13H17NO4S/c1-19-8-7-11(12(15)16)14-13(17)18-9-10-5-3-2-4-6-10/h2-6,11H,7-9H2,1H3,(H,14,17)(H,15,16) |
| InChIKey | FPKHNNQXKZMOJJ-UHFFFAOYSA-N |
| Molecular Weight | 283.0874 |
| SMILES | N(C(C(O)=O)CCSC)C(=O)OCc1ccccc1 |
| SPLASH | splash10-056r-9400000000-9ae54386d4774fcda7dc |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |