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N-[2-(trifluoromethyl)-1H-benzimidazol-4-yl]-1-adamantanecarboxamide
SpectraBase Compound ID JpEbxwdvA5x
InChI InChI=1S/C19H20F3N3O/c20-19(21,22)16-23-13-2-1-3-14(15(13)25-16)24-17(26)18-7-10-4-11(8-18)6-12(5-10)9-18/h1-3,10-12H,4-9H2,(H,23,25)(H,24,26)/t10-,11+,12-,18-
InChIKey JVJVCYBIQFKIHN-TTXAVTLXSA-N
Mol Weight 363.38 g/mol
Molecular Formula C19H20F3N3O
Exact Mass 363.155847 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 89p3WxnMkt5
Name N-[2-(trifluoromethyl)-1H-benzimidazol-4-yl]-1-adamantanecarboxamide
Alternate Name(s) N-[2-(trifluoromethyl)-1H-benzimidazol-4-yl]adamantane-1-carboxamide Tricyclo[3.3.1.1(3,7)]decane-1-carboxamide, N-[2-(trifluoromethyl)-1H-1,3-benzimidazol-7-yl]-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H20F3N3O
InChI InChI=1S/C19H20F3N3O/c20-19(21,22)16-23-13-2-1-3-14(15(13)25-16)24-17(26)18-7-10-4-11(8-18)6-12(5-10)9-18/h1-3,10-12H,4-9H2,(H,23,25)(H,24,26)/t10-,11+,12-,18-
InChIKey JVJVCYBIQFKIHN-TTXAVTLXSA-N
Molecular Weight 363.384 g/mol
SMILES [nH]1c(nc2cccc(c12)NC(=O)C12C[C@]3(C[C@](C[C@](C3)(C1)[H])(C2)[H])[H])C(F)(F)F
SPLASH splash10-000i-9800000000-2563e8ff116297b0aa5c
Wiley ID 1449526