| SpectraBase Spectrum ID |
47hrdDB3Oae |
| Name |
2,3-Dihydro-1-(4-methoxyphenylamino)-4-methyl-5-phenyl-1H-imidazole-2-thione |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
311.109233352 u |
| Formula |
C17H17N3OS |
| InChI |
InChI=1S/C17H17N3OS/c1-12-16(13-6-4-3-5-7-13)20(17(22)18-12)19-14-8-10-15(21-2)11-9-14/h3-11,19H,1-2H3,(H,18,22) |
| InChIKey |
QWNBNQRJCWTKPF-UHFFFAOYSA-N |
| Molecular Weight |
311.403 g/mol |
| SMILES |
C=1(NC(N(C1C=1C=CC=CC1)NC1=CC=C(OC)C=C1)=S)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.863915 |
