| SpectraBase Spectrum ID |
DoxgVjDGazw |
| Name |
2C-TBU N-(3-iodobenzyl) |
| Classification |
Phenethylamine designer drug |
| Copyright |
Copyright © 2024-2025 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
453.116474144 u |
| Formula |
C21H28INO2 |
| InChI |
InChI=1S/C21H28INO2/c1-21(2,3)18-13-19(24-4)16(12-20(18)25-5)9-10-23-14-15-7-6-8-17(22)11-15/h6-8,11-13,23H,9-10,14H2,1-5H3 |
| InChIKey |
GCLHBFKYRSJKKW-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
453.364 g/mol |
| Nominal Mass |
453 u |
| Quality |
969 |
| Retention Index |
2838 |
| SMILES |
C1(=C(C(C)(C)C)C=C(C(=C1)CCNCC=1C=C(C=CC1)I)OC)OC |
| SPLASH |
splash10-0a4i-1390000000-590327b070decce05285 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
N-(3-Iodobenzyl)-4-tert-butyl-2,5-dimethoxyphenethylamine
2-(4-tert-Butyl-2,5-dimethoxyphenyl)-N-(3-iodobenzyl)ethan-1-amine |
| Technique |
GC/MS |
| Wiley ID |
DD2024_020793 |
