| SpectraBase Spectrum ID |
6ZdbWxpsqgU |
| Name |
1-(2-(1-(2-(methylthio)propanoyl)piperidin-2-yl)-4-(p-tolyl)-1H-imidazol-1-yl)dodecan-1-one |
| Appearance |
Off-white solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
525.338898937 u |
| Formula |
C31H47N3O2S |
| InChI |
InChI=1S/C31H47N3O2S/c1-5-6-7-8-9-10-11-12-13-17-29(35)34-23-27(26-20-18-24(2)19-21-26)32-30(34)28-16-14-15-22-33(28)31(36)25(3)37-4/h18-21,23,25,28H,5-17,22H2,1-4H3 |
| InChIKey |
IIKNJDNTJQCGCH-UHFFFAOYSA-N |
| Instrument Name |
GCMS |
| Ionization Type |
EI |
| Molecular Weight |
525.796 g/mol |
| Quality |
112 |
| SMILES |
CSC(C(=O)N1C(CCCC1)C=1N(C=C(N1)C1=CC=C(C=C1)C)C(CCCCCCCCCCC)=O)C |
| SPLASH |
splash10-000l-2980000000-9f03ca17d0256e2dfc77 |
| Source of Spectrum |
WO2022171653A1 |
| Wiley ID |
1892729 |
