SpectraBase Spectrum ID |
BOQqtV8vZDw |
Name |
1-(2-(1H-benzo[d]imidazol-2-yl)piperidin-1-yl)-2-(methylthio)propan-1-one |
Appearance |
White solid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C16H21N3OS |
InChI |
InChI=1S/C16H21N3OS/c1-11(21-2)16(20)19-10-6-5-9-14(19)15-17-12-7-3-4-8-13(12)18-15/h3-4,7-8,11,14H,5-6,9-10H2,1-2H3,(H,17,18) |
InChIKey |
FAFRDCBBYLIVIC-UHFFFAOYSA-N |
Instrument Name |
GCMS |
Ionization Type |
EI |
Molecular Weight |
303.424 g/mol |
SMILES |
[nH]1c2ccccc2nc1C1N(CCCC1)C(C(C)SC)=O |
SPLASH |
splash10-0udi-0390000000-f0910d888abdafe34bd5 |
Sample Comments |
Isomer 2 |
Source of Spectrum |
WO2021074281A1 |
Wiley ID |
1880012 |