SpectraBase Spectrum ID |
LQIumNovhSu |
Name |
2,4,6,8,10,12-Hexa(4-trifluoromethylbenzyl)-2,4,6,8,10,12-hexaazatetracyclo[5.5.0.0(5,9).0(3,11)]dodecane |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C54H42F18N6 |
InChI |
InChI=1S/C54H42F18N6/c55-49(56,57)37-13-1-31(2-14-37)25-73-43-45-74(26-32-3-15-38(16-4-32)50(58,59)60)46-44(73)76(28-34-7-19-40(20-8-34)52(64,65)66)48(78(46)30-36-11-23-42(24-12-36)54(70,71)72)47(75(43)27-33-5-17-39(18-6-33)51(61,62)63)77(45)29-35-9-21-41(22-10-35)53(67,68)69/h1-24,43-48H,25-30H2 |
InChIKey |
DFVYDYRAPOVOOR-UHFFFAOYSA-N |
Molecular Weight |
1116.943 g/mol |
SMILES |
C12N(C3N(C4N(C2N(C4N(C3N1Cc1ccc(cc1)C(F)(F)F)Cc1ccc(cc1)C(F)(F)F)Cc1ccc(cc1)C(F)(F)F)Cc1ccc(cc1)C(F)(F)F)Cc1ccc(cc1)C(F)(F)F)Cc1ccc(cc1)C(F)(F)F |
SPLASH |
splash10-0a4i-0900000007-530270a96ab887189292 |
Source of Spectrum |
QF-9-692-1 |
Synonyms |
2,4,6,8,10,12-hexakis({[4-(trifluoromethyl)phenyl]methyl})-2,4,6,8,10,12-hexaazatetracyclo[5.5.0.0(3,11).0(5,9)]dodecane |
Wiley ID |
1558231 |