| SpectraBase Spectrum ID |
8J5ejiNCNaS |
| Name |
N,N-Bis(3-iodobenzyl)-3,4-dimethoxy-benzeneethanamine |
| Classification |
Chemical |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
612.997469047 u |
| Formula |
C24H25I2NO2 |
| InChI |
InChI=1S/C24H25I2NO2/c1-28-23-10-9-18(15-24(23)29-2)11-12-27(16-19-5-3-7-21(25)13-19)17-20-6-4-8-22(26)14-20/h3-10,13-15H,11-12,16-17H2,1-2H3 |
| InChIKey |
CVIQPBQCQWUEOL-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
613.278 g/mol |
| Nominal Mass |
613 u |
| Quality |
1000 |
| Retention Index |
3966 |
| SMILES |
C(N(CC=1C=C(C=CC1)I)CCC=1C=C(C(=CC1)OC)OC)C=1C=C(C=CC1)I |
| SPLASH |
splash10-03di-2120900000-c13e3711b7f7b9b5ea67 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
N,N-Bis(3-iodobenzyl)-3,4-dimethoxy-phenethylamine
2-(3,4-dimethoxyphenyl)-N,N-bis(3-iodobenzyl)ethan-1-amine |
| Technique |
GC/MS |
| Wiley ID |
DD2024_021775 |
