SpectraBase Spectrum ID |
8K3SYqOhgbw |
Name |
1-(3-Bromophenyl)-N-(2-(4-((3-fluoropropyl)thio)-2,5-dimethoxyphenyl)ethyl)methanimine |
Classification |
Phenethylamine designer drug derivative |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
439.061691320 u |
Formula |
C20H23BrFNO2S |
InChI |
InChI=1S/C20H23BrFNO2S/c1-24-18-13-20(26-10-4-8-22)19(25-2)12-16(18)7-9-23-14-15-5-3-6-17(21)11-15/h3,5-6,11-14H,4,7-10H2,1-2H3/b23-14+ |
InChIKey |
NJOTVYUWKGYBIY-OEAKJJBVSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
440.371 g/mol |
Nominal Mass |
439 u |
Quality |
887 |
Retention Index |
2974 |
SMILES |
C1(=C(C=C(C(=C1)OC)SCCCF)OC)CC\N=C\C=1C=C(C=CC1)Br |
SPLASH |
splash10-0006-4290100000-bbcdbedd26db5a4edb24 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
(3-bromophenyl)-N-(2-(4-((3-fluoropropyl)sulfanyl)-2,5-dimethoxyphenyl)ethyl)methanimine |
Technique |
GC/MS |
Wiley ID |
DD2024_021186 |