| SpectraBase Compound ID | 45sHWgy6Cgu |
|---|---|
| InChI | InChI=1S/C13H22S2/c1-11(2)10-5-6-12(3,9-10)13(11)14-7-4-8-15-13/h10H,4-9H2,1-3H3/t10-,12+/m1/s1 |
| InChIKey | ILEAJQKOEXIOLK-PWSUYJOCSA-N |
| Mol Weight | 242.44 g/mol |
| Molecular Formula | C13H22S2 |
| Exact Mass | 242.116293 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | K1DsB6jMwCK |
|---|---|
| Name | |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C13H22S2 |
| InChI | InChI=1S/C13H22S2/c1-11(2)10-5-6-12(3,9-10)13(11)14-7-4-8-15-13/h10H,4-9H2,1-3H3/t10-,12+/m1/s1 |
| InChIKey | ILEAJQKOEXIOLK-PWSUYJOCSA-N |
| Molecular Weight | 242.1158 |
| SMILES | C1[C@@]2(C[C@@](C)(C3(SCCCS3)C2(C)C)C1)[H] |
| SPLASH | splash10-05oc-9800000000-3df562b0e8205944ef73 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |