| SpectraBase Spectrum ID |
FBqa2ALANTK |
| Name |
1,2,3B,4,5,6-Hexahydro-8H-thiazolo[4,3-C][1,3]IMIDAZO1,2-A][1,4]benzodiazepine-8-thione |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
275.055089779 u |
| Formula |
C13H13N3S2 |
| InChI |
InChI=1S/C13H13N3S2/c17-13-9-3-1-2-4-10(9)15-6-5-14-12(15)11-7-18-8-16(11)13/h1-4,11H,5-8H2 |
| InChIKey |
OXNGXCXRGKWDIA-UHFFFAOYSA-N |
| SMILES |
C1(N2C(C=3N(C=4C1=CC=CC4)CCN3)CSC2)=S |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.920807 |
![1,2,3b,4,5,6-Hexahydro-8H-thiazolo[4,3-c][1,3]imidazo1,2-a][1,4]benzodiazepine-8-thione](/api/spectrum/FBqa2ALANTK/structure.png?h=300&w=458 "1,2,3b,4,5,6-Hexahydro-8H-thiazolo[4,3-c][1,3]imidazo1,2-a][1,4]benzodiazepine-8-thione")
