SpectraBase Spectrum ID |
CF7LIWQ3pV4 |
Name |
2C-T-16 N,N-bis(3-bromobenzyl) |
Classification |
Phenethylamine designer drug derivative |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
589.028576350 u |
Formula |
C27H29Br2NO2S |
InChI |
InChI=1S/C27H29Br2NO2S/c1-4-13-33-27-17-25(31-2)22(16-26(27)32-3)11-12-30(18-20-7-5-9-23(28)14-20)19-21-8-6-10-24(29)15-21/h4-10,14-17H,1,11-13,18-19H2,2-3H3 |
InChIKey |
XZHTYVUYBCXKSH-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
591.402 g/mol |
Nominal Mass |
589 u |
Quality |
887 |
Retention Index |
4019 |
SMILES |
C=1(C(=CC(=C(C1)OC)SCC=C)OC)CCN(CC=1C=C(C=CC1)Br)CC1=CC(=CC=C1)Br |
SPLASH |
splash10-014i-1719000000-9cf0946437e74b63f216 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
N,N-Bis(3-bromobenzyl)-4-allylthio-2,5-dimethoxy-phenylethylamine
N,N-Bis(3-bromobenzyl)-2-(2,5-dimethoxy-4-(prop-2-en-1-ylsulfanyl)phenyl)ethan-1-amine |
Technique |
GC/MS |
Wiley ID |
DD2024_021133 |