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N,N-bis(2-Fluorobenzyl)-2,5-dimethoxy-4-(2-methyl-2-propenoxy)amphetamine

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N,N-bis(2-Fluorobenzyl)-2,5-dimethoxy-4-(2-methyl-2-propenoxy)amphetamine
SpectraBase Compound ID 317Dy8c8xPd
InChI InChI=1S/C29H33F2NO3/c1-20(2)19-35-24-15-28(33-4)25(29(16-24)34-5)14-21(3)32(17-22-10-6-8-12-26(22)30)18-23-11-7-9-13-27(23)31/h6-13,15-16,21H,1,14,17-19H2,2-5H3
InChIKey QWIWRNOBIJRIJK-UHFFFAOYSA-N
Mol Weight 481.6 g/mol
Molecular Formula C29H33F2NO3
Exact Mass 481.24285 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DXth32Lr3pj
Name N,N-bis(2-Fluorobenzyl)-2,5-dimethoxy-4-(2-methyl-2-propenoxy)amphetamine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 481.242850250 u
Formula C29H33F2NO3
InChI InChI=1S/C29H33F2NO3/c1-20(2)19-35-24-15-28(33-4)25(29(16-24)34-5)14-21(3)32(17-22-10-6-8-12-26(22)30)18-23-11-7-9-13-27(23)31/h6-13,15-16,21H,1,14,17-19H2,2-5H3
InChIKey QWIWRNOBIJRIJK-UHFFFAOYSA-N
Molecular Weight 481.584 g/mol
SMILES C=1(C(=CC(=CC1OC)OCC(=C)C)OC)CC(N(CC1=C(C=CC=C1)F)CC1=C(C=CC=C1)F)C