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N-Butyl-4-benzyloxy-2,6-dimethoxyamphetamine

View entire compound with spectra: 1 NMR, and 1 MS (GC)

N-Butyl-4-benzyloxy-2,6-dimethoxyamphetamine
SpectraBase Compound ID IbSM8A43TEh
InChI InChI=1S/C22H31NO3/c1-5-6-12-23-17(2)13-20-21(24-3)14-19(15-22(20)25-4)26-16-18-10-8-7-9-11-18/h7-11,14-15,17,23H,5-6,12-13,16H2,1-4H3
InChIKey VFVQFBAHPICJIG-UHFFFAOYSA-N
Mol Weight 357.49 g/mol
Molecular Formula C22H31NO3
Exact Mass 357.230394 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2FBSosPofz2
Name N-Butyl-4-benzyloxy-2,6-dimethoxyamphetamine
Comments Computed using HOSE algorithm
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Exact Mass 357.230393859 u
Formula C22H31NO3
InChI InChI=1S/C22H31NO3/c1-5-6-12-23-17(2)13-20-21(24-3)14-19(15-22(20)25-4)26-16-18-10-8-7-9-11-18/h7-11,14-15,17,23H,5-6,12-13,16H2,1-4H3
InChIKey VFVQFBAHPICJIG-UHFFFAOYSA-N
Molecular Weight 357.494 g/mol
SMILES C1(=C(C=C(C=C1OC)OCC=1C=CC=CC1)OC)CC(NCCCC)C