| SpectraBase Spectrum ID |
KNHYFhJ840F |
| Name |
1,3-di-Morpholin-4-yl-2,4-di-p-tolyl-but-2-en-1-thione |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
436.218449450 u |
| Formula |
C26H32N2O2S |
| InChI |
InChI=1S/C26H32N2O2S/c1-20-3-7-22(8-4-20)19-24(27-11-15-29-16-12-27)25(23-9-5-21(2)6-10-23)26(31)28-13-17-30-18-14-28/h3-10H,11-19H2,1-2H3/b25-24- |
| InChIKey |
HKKCZHGKJVWQBG-IZHYLOQSSA-N |
| Molecular Weight |
436.614 g/mol |
| SMILES |
C(\C(=C/(C=1C=CC(C)=CC1)C(N1CCOCC1)=S)N1CCOCC1)C=1C=CC(=CC1)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.95085 |
