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N-[1-(2-Adamantan-1-yl-ethylamino)-2,2,2-trifluoro-1-trifluoromethyl-ethyl]-nicotinamide
SpectraBase Compound ID 1VTrCRe9MzN
InChI InChI=1S/C21H25F6N3O/c22-20(23,24)19(21(25,26)27,30-17(31)16-2-1-4-28-12-16)29-5-3-18-9-13-6-14(10-18)8-15(7-13)11-18/h1-2,4,12-15,29H,3,5-11H2,(H,30,31)/t13-,14+,15-,18+
InChIKey SRGOVDIAOFFIFE-VKNSLKGXSA-N
Mol Weight 449.44 g/mol
Molecular Formula C21H25F6N3O
Exact Mass 449.190181 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GF80OOEiT9Z
Name N-[1-(2-Adamantan-1-yl-ethylamino)-2,2,2-trifluoro-1-trifluoromethyl-ethyl]-nicotinamide
Alternate Name(s) N-[1-[2-(1-adamantyl)ethylamino]-2,2,2-trifluoro-1-(trifluoromethyl)ethyl]nicotinamide N-[1-[2-(1-adamantyl)ethylamino]-2,2,2-trifluoro-1-(trifluoromethyl)ethyl]pyridine-3-carboxamide N-[2-[2-(1-adamantyl)ethylamino]-1,1,1,3,3,3-hexafluoropropan-2-yl]-3-pyridinecarboxamide N-[2-[2-(1-adamantyl)ethylamino]-1,1,1,3,3,3-hexafluoropropan-2-yl]pyridine-3-carboxamide N-[2-[2-(1-adamantyl)ethylamino]-1,1,1,3,3,3-hexakis(fluoranyl)propan-2-yl]pyridine-3-carboxamide
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Formula C21H25F6N3O
InChI InChI=1S/C21H25F6N3O/c22-20(23,24)19(21(25,26)27,30-17(31)16-2-1-4-28-12-16)29-5-3-18-9-13-6-14(10-18)8-15(7-13)11-18/h1-2,4,12-15,29H,3,5-11H2,(H,30,31)/t13-,14+,15-,18+
InChIKey SRGOVDIAOFFIFE-VKNSLKGXSA-N
Molecular Weight 449.441 g/mol
SMILES N(C(C(F)(F)F)(C(F)(F)F)NCCC12C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)[H])[H])[H])C(c1cnccc1)=O
SPLASH splash10-00b9-1900000000-8edf1cab65a90e0234f7
Wiley ID 1464535