| SpectraBase Spectrum ID |
IpW1EPxe33m |
| Name |
Methylenedioxymethamphetamine-D5 TFA |
| Classification |
Deuterated reference standard 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 |
294.123961530 u |
| Formula |
C13H9D5F3NO3 |
| 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/i2D3,5D,8D |
| InChIKey |
KACKAPXORIPDQB-RMOCDOLISA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
294.285 g/mol |
| Nominal Mass |
294 u |
| Quality |
903 |
| Retention Index |
2366 |
| SMILES |
C(N(C([D])([D])[D])C(C(F)(F)F)=O)(C(C=1C=C2C(=CC1)OCO2)[D])(C)[D] |
| SPLASH |
splash10-08fr-2900000000-6d1bc86379b8330a20a8 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
MDMA-D5 TFA
N-(1-(1,3-benzodioxol-5-yl)(1,2-2H2)propan-2-yl)(trifluoro)-N-(2H3)methylacetamide |
| Technique |
GC/MS |
| Wiley ID |
DD2024_002148 |
