For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
3C-AL N,N-bis(2-fluorobenzyl)
SpectraBase Compound ID 2X7V081Fgnv
InChI InChI=1S/C28H31F2NO3/c1-5-14-34-28-26(32-3)16-21(17-27(28)33-4)15-20(2)31(18-22-10-6-8-12-24(22)29)19-23-11-7-9-13-25(23)30/h5-13,16-17,20H,1,14-15,18-19H2,2-4H3
InChIKey YOXCWRWNNWWHMM-UHFFFAOYSA-N
Mol Weight 467.56 g/mol
Molecular Formula C28H31F2NO3
Exact Mass 467.2272 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID JGPNexE3a6K
Name 3C-AL N,N-bis(2-fluorobenzyl)
Classification Amphetamine designer drug, stimulant, hallucinogenic
Comments Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 467.227200185 u
Formula C28H31F2NO3
InChI InChI=1S/C28H31F2NO3/c1-5-14-34-28-26(32-3)16-21(17-27(28)33-4)15-20(2)31(18-22-10-6-8-12-24(22)29)19-23-11-7-9-13-25(23)30/h5-13,16-17,20H,1,14-15,18-19H2,2-4H3
InChIKey YOXCWRWNNWWHMM-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 467.557 g/mol
Nominal Mass 467 u
Quality 987
Retention Index 3008
SMILES C=1(C(=CC(=CC1OC)CC(N(CC1=C(C=CC=C1)F)CC=1C(=CC=CC1)F)C)OC)OCC=C
SPLASH splash10-08fr-1690000000-37b58c73ee062491aa33
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N,N-Bis(2-fluorobenzyl)-4-allyloxy-3,5-dimethoxy-amphetamine 1-(3,5-dimethoxy-4-(prop-2-en-1-yloxy)phenyl)-N,N-bis(2-fluorobenzyl)propan-2-amine
Technique GC/MS
Wiley ID DD2024_020768