| SpectraBase Spectrum ID |
2NCKzFiiDdZ |
| Name |
4-(4-Chlorophenyl)-2-methyl-6-[4-[bis(4-fluorophenyl)methyl]piperazinyl-1-yl]benzonitrile |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C31H26ClF2N3 |
| InChI |
InChI=1S/C31H26ClF2N3/c1-21-18-25(22-2-8-26(32)9-3-22)19-30(29(21)20-35)36-14-16-37(17-15-36)31(23-4-10-27(33)11-5-23)24-6-12-28(34)13-7-24/h2-13,18-19,31H,14-17H2,1H3 |
| InChIKey |
HDBWYHGZUFOLDP-UHFFFAOYSA-N |
| Molecular Weight |
514.020 g/mol |
| SMILES |
c1(c(c(C)cc(c1)-c1ccc(cc1)Cl)C#N)N1CCN(CC1)C(c1ccc(cc1)F)c1ccc(cc1)F |
| SPLASH |
splash10-03di-0001090000-e115d3b8c11410c2ebc2 |
| Source of Spectrum |
K-2001-1958-6 |
| Synonyms |
2-[4-[bis(4-fluorophenyl)methyl]-1-piperazinyl]-4-(4-chlorophenyl)-6-methylbenzonitrile
2-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-4-(4-chlorophenyl)-6-methylbenzonitrile
2-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-4-(4-chlorophenyl)-6-methyl-benzonitrile
2-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-4-(4-chlorophenyl)-6-methyl-benzenecarbonitrile |
| Wiley ID |
1579550 |
![4-(4-Chlorophenyl)-2-methyl-6-[4-[bis(4-fluorophenyl)methyl]piperazinyl-1-yl]benzonitrile](/api/spectrum/2NCKzFiiDdZ/structure.png?h=300&w=458 "4-(4-Chlorophenyl)-2-methyl-6-[4-[bis(4-fluorophenyl)methyl]piperazinyl-1-yl]benzonitrile")
