| SpectraBase Spectrum ID |
BlxAFtsbjua |
| Name |
1,1'-(4,4'-Biphenylylene)bis[3-(p-methoxyphenyl)-2-thiourea] |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
514.149718439 u |
| Formula |
C28H26N4O2S2 |
| InChI |
InChI=1S/C28H26N4O2S2/c1-33-25-15-11-23(12-16-25)31-27(35)29-21-7-3-19(4-8-21)20-5-9-22(10-6-20)30-28(36)32-24-13-17-26(34-2)18-14-24/h3-18H,1-2H3,(H2,29,31,35)(H2,30,32,36) |
| InChIKey |
KQKNNBYIOPEKQW-UHFFFAOYSA-N |
| Molecular Weight |
514.662 g/mol |
| SMILES |
N(C1=CC=C(C=C1)OC)C(=S)NC=1C=CC(C=2C=CC(=CC2)NC(=S)NC2=CC=C(C=C2)OC)=CC1 |
| Spectrum/Structure Validation Score (Raman) |
0.974613 |
![1,1'-(4,4'-Biphenylylene)bis[3-(p-methoxyphenyl)-2-thiourea]](/api/spectrum/BlxAFtsbjua/structure.png?h=300&w=458 "1,1'-(4,4'-Biphenylylene)bis[3-(p-methoxyphenyl)-2-thiourea]")
