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

*Links on SpectraBase are not permalinks.
3C-DFE N,N-bis(3-bromobenzyl)
SpectraBase Compound ID KvzrhD15be5
InChI InChI=1S/C27H29Br2F2NO3/c1-18(10-21-13-24(33-2)27(25(14-21)34-3)35-17-26(30)31)32(15-19-6-4-8-22(28)11-19)16-20-7-5-9-23(29)12-20/h4-9,11-14,18,26H,10,15-17H2,1-3H3
InChIKey JHKXAZMPCVBLMC-UHFFFAOYSA-N
Mol Weight 613.34 g/mol
Molecular Formula C27H29Br2F2NO3
Exact Mass 611.048226 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 2ym7a8oHr6q
Name 3C-DFE N,N-bis(3-bromobenzyl)
Classification Amphetamine designer drug, stimulant, hallucinogenic
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 611.048226121 u
Formula C27H29Br2F2NO3
InChI InChI=1S/C27H29Br2F2NO3/c1-18(10-21-13-24(33-2)27(25(14-21)34-3)35-17-26(30)31)32(15-19-6-4-8-22(28)11-19)16-20-7-5-9-23(29)12-20/h4-9,11-14,18,26H,10,15-17H2,1-3H3
InChIKey JHKXAZMPCVBLMC-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 613.338 g/mol
Nominal Mass 611 u
Quality 913
Retention Index 4195
SMILES C=1(C(=CC(=CC1OC)CC(N(CC=1C=C(C=CC1)Br)CC=1C=C(C=CC1)Br)C)OC)OCC(F)F
SPLASH splash10-001i-1609000000-3efe09758eb6b298a3ed
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N,N-Bis(3-bromobenzyl)-4-(2,2-difluoroethoxy)-3,5-dimethoxyamphetamine N,N-Bis(3-bromobenzyl)-1-(4-(2,2-difluoroethoxy)-3,5-dimethoxyphenyl)propan-2-amine
Technique GC/MS
Wiley ID DD2024_021200