SpectraBase Spectrum ID |
JJCXaayv2zw |
Name |
1-(3-Bromophenyl)-N-(2-(4-((2,2-difluoroethyl)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 |
443.036619386 u |
Formula |
C19H20BrF2NO2S |
InChI |
InChI=1S/C19H20BrF2NO2S/c1-24-16-10-18(26-12-19(21)22)17(25-2)9-14(16)6-7-23-11-13-4-3-5-15(20)8-13/h3-5,8-11,19H,6-7,12H2,1-2H3/b23-11+ |
InChIKey |
OULKSCZGCPILBB-FOKLQQMPSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
444.335 g/mol |
Nominal Mass |
443 u |
Quality |
933 |
Retention Index |
2778 |
SMILES |
C1(=C(C=C(C(=C1)OC)CC\N=C\C=1C=C(C=CC1)Br)OC)SCC(F)F |
SPLASH |
splash10-0002-1590200000-4551e9cb1cb5e3c722ca |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
(3-bromophenyl)-N-(2-(4-((2,2-difluoroethyl)sulfanyl)-2,5-dimethoxyphenyl)ethyl)methanimine |
Technique |
GC/MS |
Wiley ID |
DD2024_021181 |