![METHYL_2-CHLORO-7-(TERT.-BUTYL)-4,7-DIHYDRO-4-OXOTHIENO-[2.3-B]-PYRIDINE-5-CARBOXYLATE](/api/spectrum/K6sUCl6VWwf/structure.png?h=300&w=458 "METHYL_2-CHLORO-7-(TERT.-BUTYL)-4,7-DIHYDRO-4-OXOTHIENO-[2.3-B]-PYRIDINE-5-CARBOXYLATE")
| SpectraBase Compound ID | HoBeSdVI63u |
|---|---|
| InChI | InChI=1S/C13H14ClNO3S/c1-13(2,3)15-6-8(12(17)18-4)10(16)7-5-9(14)19-11(7)15/h5-6H,1-4H3 |
| InChIKey | HWQYXCQIKVSPPD-UHFFFAOYSA-N |
| Mol Weight | 299.77 g/mol |
| Molecular Formula | C13H14ClNO3S |
| Exact Mass | 299.038292 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | K6sUCl6VWwf |
|---|---|
| Name | |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C13H14ClNO3S |
| InChI | InChI=1S/C13H14ClNO3S/c1-13(2,3)15-6-8(12(17)18-4)10(16)7-5-9(14)19-11(7)15/h5-6H,1-4H3 |
| InChIKey | HWQYXCQIKVSPPD-UHFFFAOYSA-N |
| Molecular Weight | 299.0380 |
| SMILES | c12cc(Cl)sc1N(C(C)(C)C)C=C(C(OC)=O)C2=O |
| SPLASH | splash10-08g3-9580000000-ec09723b138f7d4500bf |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |