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N-[1-(2-Adamantan-1-yl-ethylamino)-2,2,2-trifluoro-1-trifluoromethyl-ethyl]-3-fluoro-benzamide
SpectraBase Compound ID Hfb9zDHTDgB
InChI InChI=1S/C22H25F7N2O/c23-17-3-1-2-16(9-17)18(32)31-20(21(24,25)26,22(27,28)29)30-5-4-19-10-13-6-14(11-19)8-15(7-13)12-19/h1-3,9,13-15,30H,4-8,10-12H2,(H,31,32)/t13-,14+,15-,19+
InChIKey KQQONTFXTYDIRI-IZUZZMAOSA-N
Mol Weight 466.44 g/mol
Molecular Formula C22H25F7N2O
Exact Mass 466.185511 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 48Vkn72ZoK3
Name N-[1-(2-Adamantan-1-yl-ethylamino)-2,2,2-trifluoro-1-trifluoromethyl-ethyl]-3-fluoro-benzamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H25F7N2O
InChI InChI=1S/C22H25F7N2O/c23-17-3-1-2-16(9-17)18(32)31-20(21(24,25)26,22(27,28)29)30-5-4-19-10-13-6-14(11-19)8-15(7-13)12-19/h1-3,9,13-15,30H,4-8,10-12H2,(H,31,32)/t13-,14+,15-,19+
InChIKey KQQONTFXTYDIRI-IZUZZMAOSA-N
Molecular Weight 466.444 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(c1cc(F)ccc1)=O
SPLASH splash10-00bc-0900000000-34b484bbd9c19ac0eefa
Synonyms N-[1-[2-(1-adamantyl)ethylamino]-2,2,2-trifluoro-1-(trifluoromethyl)ethyl]-3-fluoro-benzamide N-[2-[2-(1-adamantyl)ethylamino]-1,1,1,3,3,3-hexafluoropropan-2-yl]-3-fluorobenzamide N-[2-[2-(1-adamantyl)ethylamino]-1,1,1,3,3,3-hexakis(fluoranyl)propan-2-yl]-3-fluoranyl-benzamide
Wiley ID 1464532