| SpectraBase Compound ID | 3KAGlLwuIhR |
|---|---|
| InChI | InChI=1S/C13H12OS/c1-2-10-5-7-11(8-6-10)13(14)12-4-3-9-15-12/h3-9H,2H2,1H3 |
| InChIKey | GODQIIKZEJTEPS-UHFFFAOYSA-N |
| Mol Weight | 216.3 g/mol |
| Molecular Formula | C13H12OS |
| Exact Mass | 216.060886 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | HtPlSRmmk9P |
|---|---|
| Name | SUPROFEN-ARTIFACT |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C13H12OS |
| InChI | InChI=1S/C13H12OS/c1-2-10-5-7-11(8-6-10)13(14)12-4-3-9-15-12/h3-9H,2H2,1H3 |
| InChIKey | GODQIIKZEJTEPS-UHFFFAOYSA-N |
| Instrument Name | GC |
| Molecular Weight | 216.298 g/mol |
| SMILES | c1(ccc(C(c2cccs2)=O)cc1)CC |
| SPLASH | splash10-02a9-6920000000-4ffea08738ffa9d30c6d |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |