| SpectraBase Compound ID | CLAT9mQO8QF |
|---|---|
| InChI | InChI=1S/C13H18O5S/c1-19(14,15)17-10-8-12-7-9-16-13(18-12)11-5-3-2-4-6-11/h2-6,12-13H,7-10H2,1H3 |
| InChIKey | REPJEYBOCDWJME-UHFFFAOYSA-N |
| Mol Weight | 286.34 g/mol |
| Molecular Formula | C13H18O5S |
| Exact Mass | 286.087495 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | I2Cfn5L9Bkm |
|---|---|
| Name | |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C13H18O5S |
| InChI | InChI=1S/C13H18O5S/c1-19(14,15)17-10-8-12-7-9-16-13(18-12)11-5-3-2-4-6-11/h2-6,12-13H,7-10H2,1H3 |
| InChIKey | REPJEYBOCDWJME-UHFFFAOYSA-N |
| Molecular Weight | 286.0870 |
| SMILES | CS(OCCC1OC(c2ccccc2)OCC1)(=O)=O |
| SPLASH | splash10-0ap0-9320000000-8474b44433cf0a65cb9c |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |