| SpectraBase Spectrum ID |
JH5XY6MQ3PM |
| Name |
1-(3-Bromophenyl)-N-(2-(2,5-dimethoxy-4-((2-methylpropyl)thio)phenyl)ethyl)methanimine |
| Classification |
Phenethylamine designer drug derivative |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
435.086763253 u |
| Formula |
C21H26BrNO2S |
| InChI |
InChI=1S/C21H26BrNO2S/c1-15(2)14-26-21-12-19(24-3)17(11-20(21)25-4)8-9-23-13-16-6-5-7-18(22)10-16/h5-7,10-13,15H,8-9,14H2,1-4H3/b23-13+ |
| InChIKey |
PQTYEGNTYRGSNG-YDZHTSKRSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
436.408 g/mol |
| Nominal Mass |
435 u |
| Quality |
972 |
| Retention Index |
2925 |
| SMILES |
C1(=C(C=C(C(=C1)OC)CC\N=C\C=1C=C(C=CC1)Br)OC)SCC(C)C |
| SPLASH |
splash10-000i-1690200000-90f81c56395f380c930d |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
(3-bromophenyl)-N-(2-(2,5-dimethoxy-4-((2-methylpropyl)sulfanyl)phenyl)ethyl)methanimine |
| Technique |
GC/MS |
| Wiley ID |
DD2024_021136 |
