| SpectraBase Spectrum ID |
GUmhcfNTsyu |
| Name |
1-(3,4-Methylenedioxyphenyl)butan-2-amine-A (Cl,-H) TFA |
| Classification |
Phenylbutanamine designer drug derivative |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
323.053605469 u |
| Formula |
C13H13ClF3NO3 |
| InChI |
InChI=1S/C13H13ClF3NO3/c1-2-8(18-12(19)13(15,16)17)5-7-3-4-9-11(10(7)14)21-6-20-9/h3-4,8H,2,5-6H2,1H3,(H,18,19) |
| InChIKey |
GVWAYHHQAZULTP-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
323.699 g/mol |
| Nominal Mass |
323 u |
| Quality |
921 |
| Retention Index |
2382 |
| SMILES |
C12=C(C(CC(NC(C(F)(F)F)=O)CC)=CC=C2OCO1)Cl |
| SPLASH |
splash10-03k9-1962000000-0107a8d9afe6f406e5e4 |
| Sample Comments |
Structure uncertain |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
N-(1-(4-chloro-1,3-benzodioxol-5-yl)butan-2-yl)(trifluoro)acetamide |
| Technique |
GC/MS |
| Wiley ID |
DD2024_002208 |
