| SpectraBase Spectrum ID |
EcTxgjLjWTF |
| Name |
4-(4-Fluorophenyl)-2-methyl-6-[4-[(2-chlorophenyl)(phenyl)methyl]piperazin-1-yl]benzonitrile |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C31H27ClFN3 |
| InChI |
InChI=1S/C31H27ClFN3/c1-22-19-25(23-11-13-26(33)14-12-23)20-30(28(22)21-34)35-15-17-36(18-16-35)31(24-7-3-2-4-8-24)27-9-5-6-10-29(27)32/h2-14,19-20,31H,15-18H2,1H3 |
| InChIKey |
QWSWFACWUAKJBB-UHFFFAOYSA-N |
| Molecular Weight |
496.029 g/mol |
| SMILES |
c1(c(c(C)cc(c1)-c1ccc(cc1)F)C#N)N1CCN(CC1)C(c1c(Cl)cccc1)c1ccccc1 |
| SPLASH |
splash10-0002-0000900000-3302bbb461c40a9dceec |
| Source of Spectrum |
K-2001-1958-6 |
| Synonyms |
3-{4-[(2-chlorophenyl)(phenyl)methyl]-1-piperazinyl}-4'-fluoro-5-methyl[1,1'-biphenyl]-4-carbonitrile |
| Wiley ID |
1579554 |
![4-(4-Fluorophenyl)-2-methyl-6-[4-[(2-chlorophenyl)(phenyl)methyl]piperazin-1-yl]benzonitrile](/api/spectrum/EcTxgjLjWTF/structure.png?h=300&w=458 "4-(4-Fluorophenyl)-2-methyl-6-[4-[(2-chlorophenyl)(phenyl)methyl]piperazin-1-yl]benzonitrile")
