| SpectraBase Spectrum ID |
JINxkRN7Ue0 |
| Name |
N-(3-Bromobenzyl)-1-(3,4-difluoromethylenedioxyphenyl)butan-2-amine |
| Classification |
Phenylbutanamine designer drug derivative |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
397.048898148 u |
| Formula |
C18H18BrF2NO2 |
| InChI |
InChI=1S/C18H18BrF2NO2/c1-2-15(22-11-13-4-3-5-14(19)8-13)9-12-6-7-16-17(10-12)24-18(20,21)23-16/h3-8,10,15,22H,2,9,11H2,1H3 |
| InChIKey |
VNEOQFRQSIEBSF-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
398.248 g/mol |
| Nominal Mass |
397 u |
| Quality |
999 |
| Retention Index |
2998 |
| SMILES |
C1(OC=2C(O1)=CC=C(C2)CC(NCC=1C=C(C=CC1)Br)CC)(F)F |
| SPLASH |
splash10-00b9-3970000000-e4d96fb4cd764be6453a |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
N-(3-bromobenzyl)-1-(2,2-difluoro-1,3-benzodioxol-5-yl)butan-2-amine |
| Technique |
GC/MS |
| Wiley ID |
DD2024_020427 |
