| SpectraBase Spectrum ID |
1d4bb8r6pM |
| Name |
N-Methyl-3,4-methylenedioxyamphetamine TFA |
| CAS Registry Number |
158097-59-7 |
| Classification |
Methylenedioxyamphetamine designer drug derivative |
| Comments |
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/c1-8(17(2)12(18)13(14,15)16)5-9-3-4-10-11(6-9)20-7-19-10/h3-4,6,8H,5,7H2,1-2H3 |
| InChIKey |
KACKAPXORIPDQB-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
289.254 g/mol |
| Nominal Mass |
289 u |
| Quality |
988 |
| Retention Index |
2153 |
| SMILES |
C(N(C(CC=1C=C2C(=CC1)OCO2)C)C)(C(F)(F)F)=O |
| SPLASH |
splash10-0iki-2900000000-57da4d4cdb7af7fc9d5a |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
MDMA TFA
MDMA-TFA
N-Methyl-N-trifluoroacetyl-3,4-methylenedioxyamphetamine
N-(1-(1,3-benzodioxol-5-yl)propan-2-yl)(trifluoro)-N-methylacetamide |
| Technique |
GC/MS |
| Wiley ID |
DD2024_030012 |
