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1-[1-adamantyl-[3-(trifluoromethyl)phenyl]methyl]adamantane

1-[1-adamantyl-[3-(trifluoromethyl)phenyl]methyl]adamantane

Systemtic Name:1-[1-adamantyl-[3-(trifluoromethyl)phenyl]methyl]adamantane
Openeye Name:1-[1-adamantyl-[3-(trifluoromethyl)phenyl]methyl]adamantane
CAS Name:1-[1-adamantyl-[3-(trifluoromethyl)phenyl]methyl]adamantane
IUPAC Name:1-[1-adamantyl-[3-(trifluoromethyl)phenyl]methyl]adamantane
Traditional Name:1-[1-adamantyl-[3-(trifluoromethyl)phenyl]methyl]adamantane
Formula: C28H35F3
MolecularWeight: 428.57271
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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(C4=CC(=CC=C4)C(F)(F)F)C56CC7CC(C5)CC(C7)C6


Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(C4=CC(=CC=C4)C(F)(F)F)C56CC7CC(C5)CC(C7)C6


InChI

InChI=1S/C28H35F3/c29-28(30,31)24-3-1-2-23(10-24)25(26-11-17-4-18(12-26)6-19(5-17)13-26)27-14-20-7-21(15-27)9-22(8-20)16-27/h1-3,10,17-22,25H,4-9,11-16H2


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