| SpectraBase Spectrum ID |
5WwhvgNx47c |
| Name |
1-(3,4-Methylenedioxyphenyl)butan-2-amine 2TFA |
| Classification |
Phenylbutanamine designer drug derivative |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
385.074876877 u |
| Formula |
C15H13F6NO4 |
| InChI |
InChI=1S/C15H13F6NO4/c1-2-8(22-13(24)15(19,20)21)3-7-4-9(12(23)14(16,17)18)11-10(5-7)25-6-26-11/h4-5,8H,2-3,6H2,1H3,(H,22,24) |
| InChIKey |
DSWCLYXZKJERSI-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
385.262 g/mol |
| Nominal Mass |
385 u |
| Quality |
856 |
| Retention Index |
2803 |
| SMILES |
C1(=C2C(=CC(=C1)CC(NC(C(F)(F)F)=O)CC)OCO2)C(C(F)(F)F)=O |
| SPLASH |
splash10-004r-1900000000-4dfcd6ae975cf958192e |
| Sample Comments |
TFA position uncertain |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
trifluoro-N-(1-(7-(trifluoroacetyl)-1,3-benzodioxol-5-yl)butan-2-yl)acetamide |
| Technique |
GC/MS |
| Wiley ID |
DD2024_002203 |
