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N-{4-[4-(2-Fluorophenyl)piperazin-1-yl]butyl}thiophene-2-carboxamide
SpectraBase Compound ID E42nXDGlvKE
InChI InChI=1S/C19H24FN3OS/c20-16-6-1-2-7-17(16)23-13-11-22(12-14-23)10-4-3-9-21-19(24)18-8-5-15-25-18/h1-2,5-8,15H,3-4,9-14H2,(H,21,24)
InChIKey YASSBGDOUIKMCC-UHFFFAOYSA-N
Mol Weight 361.48 g/mol
Molecular Formula C19H24FN3OS
Exact Mass 361.162412 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID I6bFzANeWvD
Name N-{4-[4-(2-Fluorophenyl)piperazin-1-yl]butyl}thiophene-2-carboxamide
Comments Computed using HOSE algorithm
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Exact Mass 361.162411741 u
Formula C19H24FN3OS
InChI InChI=1S/C19H24FN3OS/c20-16-6-1-2-7-17(16)23-13-11-22(12-14-23)10-4-3-9-21-19(24)18-8-5-15-25-18/h1-2,5-8,15H,3-4,9-14H2,(H,21,24)
InChIKey YASSBGDOUIKMCC-UHFFFAOYSA-N
Molecular Weight 361.479 g/mol
SMILES C1(=CC=CS1)C(=O)NCCCCN1CCN(CC1)C=1C(=CC=CC1)F