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5-APDB N,N-bis(3-methoxybenzyl)
SpectraBase Compound ID 8NQ4wLqdjN4
InChI InChI=1S/C27H31NO3/c1-20(14-21-10-11-27-24(15-21)12-13-31-27)28(18-22-6-4-8-25(16-22)29-2)19-23-7-5-9-26(17-23)30-3/h4-11,15-17,20H,12-14,18-19H2,1-3H3
InChIKey FKXYUBOPRMSYPO-UHFFFAOYSA-N
Mol Weight 417.55 g/mol
Molecular Formula C27H31NO3
Exact Mass 417.230394 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DkrR5Z5tyTI
Name 5-APDB N,N-bis(3-methoxybenzyl)
Classification Benzofurane analog designer drug
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 417.230393859 u
Formula C27H31NO3
InChI InChI=1S/C27H31NO3/c1-20(14-21-10-11-27-24(15-21)12-13-31-27)28(18-22-6-4-8-25(16-22)29-2)19-23-7-5-9-26(17-23)30-3/h4-11,15-17,20H,12-14,18-19H2,1-3H3
InChIKey FKXYUBOPRMSYPO-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 417.549 g/mol
Nominal Mass 417 u
Quality 995
Retention Index 3221
SMILES C(N(CC=1C=C(C=CC1)OC)CC=1C=C(C=CC1)OC)(CC=1C=C2C(=CC1)OCC2)C
SPLASH splash10-001i-1490000000-0a29218d93f6811b54e5
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 1-(2,3-Dihydro-1-benzofuran-5-yl)-N,N-bis(3-methoxybenzyl)-propan-2-amine
Technique GC/MS
Wiley ID DD2024_021543