| SpectraBase Spectrum ID |
6YP3o0dEpmh |
| Name |
1-(2-(1-isobutyryl- 4-(p-tolyl)-1H-imidazol-2-yl)piperidin-1-yl)-2-(methylthio)propan-1-one |
| Appearance |
Off white solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
413.213698422 u |
| Formula |
C23H31N3O2S |
| InChI |
InChI=1S/C23H31N3O2S/c1-15(2)22(27)26-14-19(18-11-9-16(3)10-12-18)24-21(26)20-8-6-7-13-25(20)23(28)17(4)29-5/h9-12,14-15,17,20H,6-8,13H2,1-5H3 |
| InChIKey |
ZZZXADMFUHVKIY-UHFFFAOYSA-N |
| Instrument Name |
GCMS |
| Ionization Type |
EI |
| Molecular Weight |
413.580 g/mol |
| SMILES |
C(C(C)C)(=O)N1C(=NC(=C1)C1=CC=C(C=C1)C)C1N(CCCC1)C(C(C)SC)=O |
| SPLASH |
splash10-0006-0091000000-dd74b786b1081cd35874 |
| Source of Spectrum |
WO2022171653A1 |
| Wiley ID |
1892733 |
