| SpectraBase Spectrum ID |
BSw1RYWZJem |
| Name |
10-(4-Methoxyphenyl)-1,3,7-triphenyl-4-thia-1,2,6,10-tetraaza-spiro[4.5]deca-2,6,8-trienne |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
488.167082582 u |
| Formula |
C30H24N4OS |
| InChI |
InChI=1S/C30H24N4OS/c1-35-27-19-17-25(18-20-27)33-22-21-28(23-11-5-2-6-12-23)31-30(33)34(26-15-9-4-10-16-26)32-29(36-30)24-13-7-3-8-14-24/h2-22H,1H3 |
| InChIKey |
RDJJXLMTNOBZFI-UHFFFAOYSA-N |
| Molecular Weight |
488.609 g/mol |
| SMILES |
C12(N=C(C=CN2C2=CC=C(C=C2)OC)C2=CC=CC=C2)SC(C2=CC=CC=C2)=NN1C1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.887932 |
![Spiro[4'-Phenyl-1'-(4"-methoxyphenyl)pyrimidine-3,5-diphenyl-2(1H),2'(3'H)-[1,3,4]thiadiazole](/api/spectrum/BSw1RYWZJem/structure.png?h=300&w=458 "Spiro[4'-Phenyl-1'-(4\"-methoxyphenyl)pyrimidine-3,5-diphenyl-2(1H),2'(3'H)-[1,3,4]thiadiazole")
