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N,N-Di-iso-pentyl-3,4-methylenedioxyamphetamine
SpectraBase Compound ID 8rXJ6Bpis9
InChI InChI=1S/C20H33NO2/c1-15(2)8-10-21(11-9-16(3)4)17(5)12-18-6-7-19-20(13-18)23-14-22-19/h6-7,13,15-17H,8-12,14H2,1-5H3
InChIKey BJEKWNARRJVNLW-UHFFFAOYSA-N
Mol Weight 319.5 g/mol
Molecular Formula C20H33NO2
Exact Mass 319.251129 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8FcDVBXIOHY
Name N,N-Di-iso-pentyl-3,4-methylenedioxyamphetamine
Classification Methylenedioxyamphetamine designer drug, stimulant, entactogenic
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 319.251129305 u
Formula C20H33NO2
InChI InChI=1S/C20H33NO2/c1-15(2)8-10-21(11-9-16(3)4)17(5)12-18-6-7-19-20(13-18)23-14-22-19/h6-7,13,15-17H,8-12,14H2,1-5H3
InChIKey BJEKWNARRJVNLW-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 319.489 g/mol
Nominal Mass 319 u
Quality 996
Retention Index 2122
SMILES C1=2C(=CC(CC(N(CCC(C)C)CCC(C)C)C)=CC2)OCO1
SPLASH splash10-001i-3900000000-7bad1c9b9b12587a548a
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms MDA,N,N-Diisopentyl- N,N-Di-(3-methylbutyl)-3,4-methylenedioxyamphetamine
Technique GC/MS
Wiley ID DD2024_014886