| SpectraBase Spectrum ID |
C9aEZs9VBvG |
| Name |
1-(p-Methoxyphenyl)-4-methyl-6-phenyl-2[1H]pyrimidinethione |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
308.098334316 u |
| Formula |
C18H16N2OS |
| InChI |
InChI=1S/C18H16N2OS/c1-13-12-17(14-6-4-3-5-7-14)20(18(22)19-13)15-8-10-16(21-2)11-9-15/h3-12H,1-2H3 |
| InChIKey |
GGEPDHFVNNGMGA-UHFFFAOYSA-N |
| Molecular Weight |
308.399 g/mol |
| SMILES |
C1(N(C(C=2C=CC=CC2)=CC(=N1)C)C=1C=CC(=CC1)OC)=S |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.905104 |
![1-(p-Methoxyphenyl)-4-methyl-6-phenyl-2[1H]pyrimidinethione](/api/spectrum/C9aEZs9VBvG/structure.png?h=300&w=458 "1-(p-Methoxyphenyl)-4-methyl-6-phenyl-2[1H]pyrimidinethione")
