| SpectraBase Spectrum ID |
LYfpkn4EwOp |
| Name |
2-(methylthio)-1-(2-(5-(4-nitrophenyl)-1H-imidazol-2-yl)piperidin-1-yl)propan-1-one |
| Appearance |
Pale yellow solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H22N4O3S |
| InChI |
InChI=1S/C18H22N4O3S/c1-12(26-2)18(23)21-10-4-3-5-16(21)17-19-11-15(20-17)13-6-8-14(9-7-13)22(24)25/h6-9,11-12,16H,3-5,10H2,1-2H3,(H,19,20) |
| InChIKey |
GIDFTOOPHVCUMN-UHFFFAOYSA-N |
| Instrument Name |
GCMS |
| Ionization Type |
EI |
| Molecular Weight |
374.459 g/mol |
| SMILES |
[nH]1c(cnc1C1N(C(C(SC)C)=O)CCCC1)-c1ccc(cc1)[N+](=O)[O-] |
| SPLASH |
splash10-00fr-4090000000-c9e7cb4ec85c5c750ecd |
| Source of Spectrum |
WO2021074281A1 |
| Wiley ID |
1880017 |
