| SpectraBase Compound ID | EiUjHL4dVbP |
|---|---|
| InChI | InChI=1S/C9H16O2S2/c1-11-9(10)5-3-2-4-8(13)6-7-12/h12H,2-7H2,1H3 |
| InChIKey | IQYXXYFDWOYYIG-UHFFFAOYSA-N |
| Mol Weight | 220.34 g/mol |
| Molecular Formula | C9H16O2S2 |
| Exact Mass | 220.059172 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3cTxh9RHTRG |
|---|---|
| Name | OCTOTIAMINE-ARTIFACT 1 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C9H16O2S2 |
| InChI | InChI=1S/C9H16O2S2/c1-11-9(10)5-3-2-4-8(13)6-7-12/h12H,2-7H2,1H3 |
| InChIKey | IQYXXYFDWOYYIG-UHFFFAOYSA-N |
| Instrument Name | GC |
| Molecular Weight | 220.345 g/mol |
| SMILES | SCCC(CCCCC(OC)=O)=S |
| SPLASH | splash10-05gj-9400000000-0802a03d8c65d36f7418 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |