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1-piperazineacetamide, N-[4-(dimethylamino)phenyl]-4-(4-fluorophenyl)-
SpectraBase Compound ID 9rE2II75rUG
InChI InChI=1S/C20H25FN4O/c1-23(2)18-9-5-17(6-10-18)22-20(26)15-24-11-13-25(14-12-24)19-7-3-16(21)4-8-19/h3-10H,11-15H2,1-2H3,(H,22,26)
InChIKey KVYFSTNIUTYOMR-UHFFFAOYSA-N
Mol Weight 356.45 g/mol
Molecular Formula C20H25FN4O
Exact Mass 356.20124 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CFLi6IgDfbB
Name 1-Piperazineacetamide, N-[4-(dimethylamino)phenyl]-4-(4-fluorophenyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 356.201239603 u
Formula C20H25FN4O
InChI InChI=1S/C20H25FN4O/c1-23(2)18-9-5-17(6-10-18)22-20(26)15-24-11-13-25(14-12-24)19-7-3-16(21)4-8-19/h3-10H,11-15H2,1-2H3,(H,22,26)
InChIKey KVYFSTNIUTYOMR-UHFFFAOYSA-N
Molecular Weight 356.445 g/mol
SMILES N(C(CN1CCN(C2=CC=C(C=C2)F)CC1)=O)C=1C=CC(=CC1)N(C)C