| SpectraBase Compound ID | 54Iog9KQnyK |
|---|---|
| InChI | InChI=1S/C12H18S2/c1-2-14-12(13-1)10-4-8-3-9(6-10)7-11(12)5-8/h8-11H,1-7H2/t8-,9+,10-,11+ |
| InChIKey | MVBPWAFKKIVQMV-DTIDVZRVSA-N |
| Mol Weight | 226.4 g/mol |
| Molecular Formula | C12H18S2 |
| Exact Mass | 226.084993 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | JuGxMt3LtUM |
|---|---|
| Name | |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C12H18S2 |
| InChI | InChI=1S/C12H18S2/c1-2-14-12(13-1)10-4-8-3-9(6-10)7-11(12)5-8/h8-11H,1-7H2/t8-,9+,10-,11+ |
| InChIKey | MVBPWAFKKIVQMV-DTIDVZRVSA-N |
| Molecular Weight | 226.0846 |
| SMILES | [C@]12(C[C@]3(C4(SCCS4)[C@@](C1)(C[C@](C3)(C2)[H])[H])[H])[H] |
| SPLASH | splash10-002b-6920000000-7d44dd57997b61977873 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |