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MDMA-D5 TFA
SpectraBase Compound ID 1RJ8DKBZGmb
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
Mol Weight 294.28 g/mol
Molecular Formula C13H9D5F3NO3
Exact Mass 294.123962 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3XUKpFX0CsI
Name N-[2-(1,3-benzodioxol-5-yl)-1,2-dideuterio-1-methyl-ethyl]-2,2,2-trifluoro-N-(trideuteriomethyl)acetamide
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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
Literature Reference DOI 10.1002/rcm.3010
Molecular Weight 294.285 g/mol
SMILES c1c(cc2c(c1)OCO2)C([D])C(N(C(C(F)(F)F)=O)C([D])([D])[D])(C)[D]
SPLASH splash10-08fr-2900000000-a690740872343f4d63fc
Source of Spectrum RCM-21-1713-MDMA_d5_TFA
Synonyms N-(1-(benzo[d][1,3]dioxol-5-yl)propan-2-yl-1,2-d2)-2,2,2-trifluoro-N-(methyl-d3)acetamide
Wiley ID 1814348