| SpectraBase Spectrum ID |
274kmVo0rbd |
| Name |
Tetrahydropyrazolo[1,2-A][1,2,4]triazole-1-thione, 6,6-dimethyl-2,3-diphenyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
323.145618862 u |
| Formula |
C19H21N3S |
| InChI |
InChI=1S/C19H21N3S/c1-19(2)13-20-17(15-9-5-3-6-10-15)22(18(23)21(20)14-19)16-11-7-4-8-12-16/h3-12,17H,13-14H2,1-2H3 |
| InChIKey |
QDRVEILXRSWJSO-UHFFFAOYSA-N |
| Molecular Weight |
323.458 g/mol |
| SMILES |
C1=CC=C(C=C1)C1N(C(N2CC(CN12)(C)C)=S)C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.865313 |
![Tetrahydropyrazolo[1,2-a][1,2,4]triazole-1-thione, 6,6-dimethyl-2,3-diphenyl-](/api/spectrum/274kmVo0rbd/structure.png?h=300&w=458 "Tetrahydropyrazolo[1,2-a][1,2,4]triazole-1-thione, 6,6-dimethyl-2,3-diphenyl-")
