![2,3,4,7,8,9,10,11-Octahydro[1]benzothieno[2',3':4,5]pyrimido[1,2-a]azepin-13(1H)-one](/api/spectrum/GiyjxPSSUD4/structure.png?h=300&w=458 "2,3,4,7,8,9,10,11-Octahydro[1]benzothieno[2',3':4,5]pyrimido[1,2-a]azepin-13(1H)-one")
| SpectraBase Compound ID | C5Cgq69owKW |
|---|---|
| InChI | InChI=1S/C15H18N2OS/c18-15-13-10-6-3-4-7-11(10)19-14(13)16-12-8-2-1-5-9-17(12)15/h1-9H2 |
| InChIKey | NNKREBHGPQQYOG-UHFFFAOYSA-N |
| Mol Weight | 274.38 g/mol |
| Molecular Formula | C15H18N2OS |
| Exact Mass | 274.113984 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | GiyjxPSSUD4 |
|---|---|
| Name | 2,3,4,7,8,9,10,11-Octahydro[1]benzothieno[2',3':4,5]pyrimido[1,2-a]azepin-13(1H)-one |
| CAS Registry Number | 56929-67-0 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H18N2OS |
| InChI | InChI=1S/C15H18N2OS/c18-15-13-10-6-3-4-7-11(10)19-14(13)16-12-8-2-1-5-9-17(12)15/h1-9H2 |
| InChIKey | NNKREBHGPQQYOG-UHFFFAOYSA-N |
| Literature Reference DOI | 10.1002/oms.1210210209 |
| Molecular Weight | 274.382 g/mol |
| SMILES | c12c(N=C3N(C2=O)CCCCC3)sc2c1CCCC2 |
| SPLASH | splash10-00dl-3090000000-df117bc86d9031508e54 |
| Source of Spectrum | O-21-91-1 |
| Wiley ID | 1278077 |