| SpectraBase Spectrum ID |
5V5yLyTgsG8 |
| Name |
1-(2,3-Methylenedioxyphenyl)butan-2-amine TFA |
| Classification |
Phenylbutanamine designer drug derivative |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
289.092577801 u |
| Formula |
C13H14F3NO3 |
| InChI |
InChI=1S/C13H14F3NO3/c1-2-9(17-12(18)13(14,15)16)6-8-4-3-5-10-11(8)20-7-19-10/h3-5,9H,2,6-7H2,1H3,(H,17,18) |
| InChIKey |
CQLQFVCOIIAGHW-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
289.254 g/mol |
| Nominal Mass |
289 u |
| Quality |
996 |
| Retention Index |
2192 |
| SMILES |
C=1(C2=C(OCO2)C=CC1)CC(NC(C(F)(F)F)=O)CC |
| SPLASH |
splash10-0fbi-4910000000-078c2592fe356ff47a64 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
2,3-BDB TFA
N-(1-(1,3-benzodioxol-4-yl)butan-2-yl)(trifluoro)acetamide |
| Technique |
GC/MS |
| Wiley ID |
DD2024_002201 |
