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N2-(4-Methoxybenzyl)-5-methoxytryptamine-A (CH2O,-H2O)

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

N2-(4-Methoxybenzyl)-5-methoxytryptamine-A (CH2O,-H2O)
SpectraBase Compound ID EaMpbInq3Uo
InChI InChI=1S/C20H22N2O2/c1-23-15-5-3-14(4-6-15)12-22-10-9-17-18-11-16(24-2)7-8-19(18)21-20(17)13-22/h3-8,11,21H,9-10,12-13H2,1-2H3
InChIKey UVLVOQQKDIBXKW-UHFFFAOYSA-N
Mol Weight 322.41 g/mol
Molecular Formula C20H22N2O2
Exact Mass 322.168128 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1LKoZNnHgWl
Name N2-(4-Methoxybenzyl)-5-methoxytryptamine-A (CH2O,-H2O)
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 322.168127954 u
Formula C20H22N2O2
InChI InChI=1S/C20H22N2O2/c1-23-15-5-3-14(4-6-15)12-22-10-9-17-18-11-16(24-2)7-8-19(18)21-20(17)13-22/h3-8,11,21H,9-10,12-13H2,1-2H3
InChIKey UVLVOQQKDIBXKW-UHFFFAOYSA-N
Molecular Weight 322.408 g/mol
SMILES C=12C3=C(NC2=CC=C(C1)OC)CN(CC=1C=CC(=CC1)OC)CC3