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1-Benzyl-2-(piperazin-1-yl)-1H-benzo[D]imidazole, N-trifluoroacetyl-
SpectraBase Compound ID A0zYKk2GiMt
InChI InChI=1S/C20H19F3N4O/c21-20(22,23)18(28)25-10-12-26(13-11-25)19-24-16-8-4-5-9-17(16)27(19)14-15-6-2-1-3-7-15/h1-9H,10-14H2
InChIKey HYPMLMLVHIJKBV-UHFFFAOYSA-N
Mol Weight 388.39 g/mol
Molecular Formula C20H19F3N4O
Exact Mass 388.151096 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3IwCgGVF9VF
Name 1-Benzyl-2-(piperazin-1-yl)-1H-benzo[D]imidazole, N-trifluoroacetyl-
Comments Computed using HOSE algorithm
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Exact Mass 388.151095736 u
Formula C20H19F3N4O
InChI InChI=1S/C20H19F3N4O/c21-20(22,23)18(28)25-10-12-26(13-11-25)19-24-16-8-4-5-9-17(16)27(19)14-15-6-2-1-3-7-15/h1-9H,10-14H2
InChIKey HYPMLMLVHIJKBV-UHFFFAOYSA-N
Molecular Weight 388.394 g/mol
SMILES C1N(CCN(C1)C(C(F)(F)F)=O)C=1N(C2=C(N1)C=CC=C2)CC1=CC=CC=C1