![1,3,4,5,7,8,9,10-Octahydro-2H-[1]benzothieno[3,2-b]azepin-2-one](/api/spectrum/16WOwPCfAaz/structure.png?h=300&w=458 "1,3,4,5,7,8,9,10-Octahydro-2H-[1]benzothieno[3,2-b]azepin-2-one")
| SpectraBase Compound ID | CX4XbrRsvu6 |
|---|---|
| InChI | InChI=1S/C12H15NOS/c14-11-7-3-6-10-12(13-11)8-4-1-2-5-9(8)15-10/h1-7H2,(H,13,14) |
| InChIKey | KQFUXFSGBNMMFQ-UHFFFAOYSA-N |
| Mol Weight | 221.32 g/mol |
| Molecular Formula | C12H15NOS |
| Exact Mass | 221.087435 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 16WOwPCfAaz |
|---|---|
| Name | 1,3,4,5,7,8,9,10-Octahydro-2H-[1]benzothieno[3,2-b]azepin-2-one |
| CAS Registry Number | 53688-43-0 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H15NOS |
| InChI | InChI=1S/C12H15NOS/c14-11-7-3-6-10-12(13-11)8-4-1-2-5-9(8)15-10/h1-7H2,(H,13,14) |
| InChIKey | KQFUXFSGBNMMFQ-UHFFFAOYSA-N |
| Molecular Weight | 221.318 g/mol |
| SMILES | N1C(CCCc2sc3c(c12)CCCC3)=O |
| SPLASH | splash10-014i-2920000000-9361f5eef79792a89c79 |
| Source of Spectrum | AD-0-2532-0 |
| Synonyms | 1,3,4,5,7,8,9,10-octahydro-[1]benzothiolo[3,2-b]azepin-2-one 1,3,4,5,7,8,9,10-octahydrobenzothiopheno[3,2-b]azepin-2-one 1,3,4,5,7,8,9,10-octahydrobenzothiophen[3,2-b]azepin-2-one 1H-Benzothieno[3,2-b]azepin-2(3H)-one, 4,5,7,8,9,10-hexahydro- |
| Wiley ID | 1425385 |