| SpectraBase Compound ID | 1BBVazkrZya |
|---|---|
| InChI | InChI=1S/C12H15NS2/c1-2-5-11(6-3-1)7-4-9-14-12-13-8-10-15-12/h1-3,5-6H,4,7-10H2 |
| InChIKey | MHJXWAFYNWAOPI-UHFFFAOYSA-N |
| Mol Weight | 237.38 g/mol |
| Molecular Formula | C12H15NS2 |
| Exact Mass | 237.064592 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7t48ifDM3z0 |
|---|---|
| Name | 2-(3-PHENYLALLYLSULFANYL)-4,5-DIHYDROTHIAZOLE |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C12H13NS2 |
| InChI | InChI=1S/C12H15NS2/c1-2-5-11(6-3-1)7-4-9-14-12-13-8-10-15-12/h1-3,5-6H,4,7-10H2 |
| InChIKey | MHJXWAFYNWAOPI-UHFFFAOYSA-N |
| Molecular Weight | 237.0643 |
| SMILES | C1CSC(SCCCc2ccccc2)=N1 |
| SPLASH | splash10-014i-4940000000-f72ed9383cf05265d2c0 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |