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1-(3-Methoxybenzyl)-4-piperidinamine, N-pentafluoropropionyl-
SpectraBase Compound ID 4qLF8tck95M
InChI InChI=1S/C16H19F5N2O2/c1-25-13-4-2-3-11(9-13)10-23-7-5-12(6-8-23)22-14(24)15(17,18)16(19,20)21/h2-4,9,12H,5-8,10H2,1H3,(H,22,24)
InChIKey JIKJVDZEUCYDBF-UHFFFAOYSA-N
Mol Weight 366.33 g/mol
Molecular Formula C16H19F5N2O2
Exact Mass 366.136669 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8U41z5yi4MO
Name 1-(3-Methoxybenzyl)-4-piperidinamine, N-pentafluoropropionyl-
Comments Computed using HOSE algorithm
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Exact Mass 366.136668673 u
Formula C16H19F5N2O2
InChI InChI=1S/C16H19F5N2O2/c1-25-13-4-2-3-11(9-13)10-23-7-5-12(6-8-23)22-14(24)15(17,18)16(19,20)21/h2-4,9,12H,5-8,10H2,1H3,(H,22,24)
InChIKey JIKJVDZEUCYDBF-UHFFFAOYSA-N
Molecular Weight 366.332 g/mol
SMILES C1N(CCC(C1)NC(C(C(F)(F)F)(F)F)=O)CC1=CC(=CC=C1)OC