| SpectraBase Spectrum ID |
B3V7fhjIFdL |
| Name |
4-(4-Chlorophenyl)-2-(2-phenylethyl)-6-[4-[bis(4-fluorophenyl)methyl]piperazinyl-1-yl]benzonitrile |
| Alternate Name(s) |
2-[4-[bis(4-fluorophenyl)methyl]-1-piperazinyl]-4-(4-chlorophenyl)-6-(2-phenylethyl)benzonitrile
2-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-4-(4-chlorophenyl)-6-(2-phenylethyl)benzonitrile
2-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-4-(4-chlorophenyl)-6-(2-phenylethyl)benzenecarbonitrile |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C38H32ClF2N3 |
| InChI |
InChI=1S/C38H32ClF2N3/c39-33-14-8-28(9-15-33)32-24-31(7-6-27-4-2-1-3-5-27)36(26-42)37(25-32)43-20-22-44(23-21-43)38(29-10-16-34(40)17-11-29)30-12-18-35(41)19-13-30/h1-5,8-19,24-25,38H,6-7,20-23H2 |
| InChIKey |
ZPFSPZHQTRGWLD-UHFFFAOYSA-N |
| Molecular Weight |
604.145 g/mol |
| SMILES |
c1(c(c(CCc2ccccc2)cc(c1)-c1ccc(cc1)Cl)C#N)N1CCN(CC1)C(c1ccc(cc1)F)c1ccc(cc1)F |
| SPLASH |
splash10-0udi-0000009000-848e92baf0f4176cda22 |
| Source of Spectrum |
K-2001-1958-6 |
| Wiley ID |
1579545 |
![4-(4-Chlorophenyl)-2-(2-phenylethyl)-6-[4-[bis(4-fluorophenyl)methyl]piperazinyl-1-yl]benzonitrile](/api/spectrum/B3V7fhjIFdL/structure.png?h=300&w=458 "4-(4-Chlorophenyl)-2-(2-phenylethyl)-6-[4-[bis(4-fluorophenyl)methyl]piperazinyl-1-yl]benzonitrile")
