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2C-tfe N,N-bis(4-Methoxybenzyl)

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2C-tfe N,N-bis(4-Methoxybenzyl)
SpectraBase Compound ID 9bPLtJoCjhp
InChI InChI=1S/C28H32F3NO4/c1-33-24-9-5-20(6-10-24)18-32(19-21-7-11-25(34-2)12-8-21)14-13-22-15-27(36-4)23(16-26(22)35-3)17-28(29,30)31/h5-12,15-16H,13-14,17-19H2,1-4H3
InChIKey HYIGHLSIWJXJOY-UHFFFAOYSA-N
Mol Weight 503.6 g/mol
Molecular Formula C28H32F3NO4
Exact Mass 503.228343 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GD0LO64t973
Name 2C-tfe N,N-bis(4-Methoxybenzyl)
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 503.228342999 u
Formula C28H32F3NO4
InChI InChI=1S/C28H32F3NO4/c1-33-24-9-5-20(6-10-24)18-32(19-21-7-11-25(34-2)12-8-21)14-13-22-15-27(36-4)23(16-26(22)35-3)17-28(29,30)31/h5-12,15-16H,13-14,17-19H2,1-4H3
InChIKey HYIGHLSIWJXJOY-UHFFFAOYSA-N
Molecular Weight 503.562 g/mol
SMILES C=1(C(=CC(=C(C1)OC)CC(F)(F)F)OC)CCN(CC=1C=CC(=CC1)OC)CC1=CC=C(C=C1)OC