SpectraBase Spectrum ID |
K1R5GrNVOF4 |
Name |
Piperazine, 1-(2,6-dimethylphenyl)-4-(4-fluorobenzenesulfonyl)- |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
348.130777259 u |
Formula |
C18H21FN2O2S |
InChI |
InChI=1S/C18H21FN2O2S/c1-14-4-3-5-15(2)18(14)20-10-12-21(13-11-20)24(22,23)17-8-6-16(19)7-9-17/h3-9H,10-13H2,1-2H3 |
InChIKey |
YCUJTBKQNNHYMV-UHFFFAOYSA-N |
Molecular Weight |
348.436 g/mol |
SMILES |
CC1=C(C(C)=CC=C1)N1CCN(S(C2=CC=C(C=C2)F)(=O)=O)CC1 |