| SpectraBase Compound ID | AlsX8dRz8hn |
|---|---|
| InChI | InChI=1S/C8H14S.C2H4O2.2BrH/c1-3-7-5-2-6-8(4-1)9-7;1-2(3)4;;/h7-8H,1-6H2;1H3,(H,3,4);2*1H/t7-,8+;;; |
| InChIKey | ZKAXPPLUJWDBNV-UZCMYEMWSA-N |
| Mol Weight | 364.14 g/mol |
| Molecular Formula | C10H20Br2O2S |
| Exact Mass | 361.955077 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | GcKFf8qnFDl |
|---|---|
| Name | |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C10H14O2SBr2 |
| InChI | InChI=1S/C8H14S.C2H4O2.2BrH/c1-3-7-5-2-6-8(4-1)9-7;1-2(3)4;;/h7-8H,1-6H2;1H3,(H,3,4);2*1H/t7-,8+;;; |
| InChIKey | ZKAXPPLUJWDBNV-UZCMYEMWSA-N |
| Molecular Weight | 361.9545 |
| SMILES | Br.C1CC[C@]2(CCC[C@@]1(S2)[H])[H].Br.OC(=O)C |
| SPLASH | splash10-00mo-9440000000-b352ddacffaa2fe3171a |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |