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bis(1-adamantyl)-[3-(trifluoromethyl)phenyl]methanol

bis(1-adamantyl)-[3-(trifluoromethyl)phenyl]methanol

Systemtic Name:bis(1-adamantyl)-[3-(trifluoromethyl)phenyl]methanol
Openeye Name:bis(1-adamantyl)-[3-(trifluoromethyl)phenyl]methanol
CAS Name:bis(1-adamantyl)-[3-(trifluoromethyl)phenyl]methanol
IUPAC Name:bis(1-adamantyl)-[3-(trifluoromethyl)phenyl]methanol
Traditional Name:bis(1-adamantyl)-[3-(trifluoromethyl)phenyl]methanol
Formula: C28H35F3O
MolecularWeight: 444.57211
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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)O


Isomeric SMILES

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


InChI

InChI=1S/C28H35F3O/c29-28(30,31)24-3-1-2-23(10-24)27(32,25-11-17-4-18(12-25)6-19(5-17)13-25)26-14-20-7-21(15-26)9-22(8-20)16-26/h1-3,10,17-22,32H,4-9,11-16H2


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