| SpectraBase Spectrum ID |
L9Zj23IsDFx |
| Name |
2,2'-bis{[3,5-bis(Trifluoromethyl)phenyl]-phosphinomethyl}-1,1'-biphenyl |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
1094.097000681 u |
| Formula |
C46H24F24P2 |
| InChI |
InChI=1S/C46H24F24P2/c47-39(48,49)25-9-26(40(50,51)52)14-33(13-25)71(34-15-27(41(53,54)55)10-28(16-34)42(56,57)58)21-23-5-1-3-7-37(23)38-8-4-2-6-24(38)22-72(35-17-29(43(59,60)61)11-30(18-35)44(62,63)64)36-19-31(45(65,66)67)12-32(20-36)46(68,69)70/h1-20H,21-22H2 |
| InChIKey |
CHKXKRMCMUJPBS-UHFFFAOYSA-N |
| Molecular Weight |
1094.607 g/mol |
| SMILES |
C=1(P(C=2C=C(C(F)(F)F)C=C(C(F)(F)F)C2)CC=2C(C=3C(CP(C4=CC(C(F)(F)F)=CC(C(F)(F)F)=C4)C=4C=C(C(F)(F)F)C=C(C(F)(F)F)C4)=CC=CC3)=CC=CC2)C=C(C(F)(F)F)C=C(C(F)(F)F)C1 |