SpectraBase Compound ID | ESrL19RYhPA |
---|---|
InChI | InChI=1S/C9H8N2S/c1-2-4-8(5-3-1)12-9-10-6-7-11-9/h1-7H,(H,10,11) |
InChIKey | FPLYMSUAUOSKLM-UHFFFAOYSA-N |
Mol Weight | 176.24 g/mol |
Molecular Formula | C9H8N2S |
Exact Mass | 176.040819 g/mol |
SpectraBase Spectrum ID | HZZShOCKylY |
---|---|
Name | 2-(Phenylthio)-1H-imidazole |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 176.040819440 u |
Formula | C9H8N2S |
InChI | InChI=1S/C9H8N2S/c1-2-4-8(5-3-1)12-9-10-6-7-11-9/h1-7H,(H,10,11) |
InChIKey | FPLYMSUAUOSKLM-UHFFFAOYSA-N |
Molecular Weight | 176.237 g/mol |
SMILES | C1(=NC=CN1)SC1=CC=CC=C1 |