![4-HYDROXY-4,5,6,7,8,9,10,11-OCTAHYDRO-THIENO-[2.3-D]-AZECINE-9-CARBONITRILE](/api/spectrum/IVlG5Dq6PSm/structure.png?h=300&w=458 "4-HYDROXY-4,5,6,7,8,9,10,11-OCTAHYDRO-THIENO-[2.3-D]-AZECINE-9-CARBONITRILE")
| SpectraBase Compound ID | FbsmdQ8DeTS |
|---|---|
| InChI | InChI=1S/C12H16N2OS/c13-9-14-6-2-1-3-11(15)10-5-8-16-12(10)4-7-14/h5,8,11,15H,1-4,6-7H2 |
| InChIKey | YAQHKJCDWVEEGG-UHFFFAOYSA-N |
| Mol Weight | 236.33 g/mol |
| Molecular Formula | C12H16N2OS |
| Exact Mass | 236.098334 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | IVlG5Dq6PSm |
|---|---|
| Name | 9-Cyano-4,5,6,7,8,9,10,11-octahydrothieno[2,3-d]azecin-4-ol |
| Alternate Name(s) | 4-Hydroxy-4,5,6,7,8,9,10,11-octahydrothieno[2,3-d]azecine-9-carbonitrile 4-Hydroxy-5,6,7,8,10,11-hexahydro-4H-thieno[2,3-d]azecine-9-carbonitrile 4-Hydroxy-5,6,7,8,10,11-hexahydro-4H-thien[2,3-d]azecine-9-carbonitrile 4-Oxidanyl-5,6,7,8,10,11-hexahydro-4H-thieno[2,3-d]azecine-9-carbonitrile |
| CAS Registry Number | 90779-18-3 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H16N2OS |
| InChI | InChI=1S/C12H16N2OS/c13-9-14-6-2-1-3-11(15)10-5-8-16-12(10)4-7-14/h5,8,11,15H,1-4,6-7H2 |
| InChIKey | YAQHKJCDWVEEGG-UHFFFAOYSA-N |
| Molecular Weight | 236.333 g/mol |
| SMILES | OC1CCCCN(CCc2c1ccs2)C#N |
| SPLASH | splash10-03dl-1900000000-16a5d03d9a5ab5b18a58 |
| Source of Spectrum | B-37-375-0 |
| Wiley ID | 1237843 |