| SpectraBase Compound ID | 5dsZ4fXCRrM |
|---|---|
| InChI | InChI=1S/C12H14O3S/c1-14-11(13)10(12(16)15-2)8-9-6-4-3-5-7-9/h3-7,10H,8H2,1-2H3 |
| InChIKey | IZCGOOKHBNMAOF-UHFFFAOYSA-N |
| Mol Weight | 238.3 g/mol |
| Molecular Formula | C12H14O3S |
| Exact Mass | 238.066365 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 4u5Je3N6Rfc |
|---|---|
| Name | |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C12H14O3S |
| InChI | InChI=1S/C12H14O3S/c1-14-11(13)10(12(16)15-2)8-9-6-4-3-5-7-9/h3-7,10H,8H2,1-2H3 |
| InChIKey | IZCGOOKHBNMAOF-UHFFFAOYSA-N |
| Molecular Weight | 238.0660 |
| SMILES | c1ccc(CC(C(OC)=O)C(OC)=S)cc1 |
| SPLASH | splash10-01ox-7900000000-cd3990cc0c4af0f4cc29 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |