For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
N-Methyl-1-(2-iodo-4,5-methylenedioxyphenyl)butan-2-amine
SpectraBase Compound ID L78iobzDOOO
InChI InChI=1S/C12H16INO2/c1-3-9(14-2)4-8-5-11-12(6-10(8)13)16-7-15-11/h5-6,9,14H,3-4,7H2,1-2H3
InChIKey FPODXQZNVJHBFY-UHFFFAOYSA-N
Mol Weight 333.17 g/mol
Molecular Formula C12H16INO2
Exact Mass 333.022574 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID JHCBzNrgCjA
Name N-Methyl-1-(2-iodo-4,5-methylenedioxyphenyl)butan-2-amine
Classification Methylenedioxyphenylbutanamine designer drug
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 333.022573757 u
Formula C12H16INO2
InChI InChI=1S/C12H16INO2/c1-3-9(14-2)4-8-5-11-12(6-10(8)13)16-7-15-11/h5-6,9,14H,3-4,7H2,1-2H3
InChIKey FPODXQZNVJHBFY-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 333.169 g/mol
Nominal Mass 333 u
Quality 997
Retention Index 2236
SMILES C1(=C(C=C2C(=C1)OCO2)I)CC(NC)CC
SPLASH splash10-00di-9100000000-5785b96ea1c5f3d47975
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Iodo-MBDB 1-(6-iodo-1,3-benzodioxol-5-yl)-N-methylbutan-2-amine
Technique GC/MS
Wiley ID DD2024_002814