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3,4-Methylenedioxyamphetamine
SpectraBase Compound ID 1oQIBCEgTso
InChI InChI=1S/C10H13NO2/c1-7(11)4-8-2-3-9-10(5-8)13-6-12-9/h2-3,5,7H,4,6,11H2,1H3
InChIKey NGBBVGZWCFBOGO-UHFFFAOYSA-N
Mol Weight 179.22 g/mol
Molecular Formula C10H13NO2
Exact Mass 179.094629 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID DbzhoxDgcve
Name 3,4-Methylenedioxyamphetamine
Source of Sample Lipomed AG
Catalog Number Free base of MDA-79-HC-1LM
Lot Number Free base of 94.3B10.2L1
Accessory DurasamplIR II
CAS Registry Number 4764-17-4
Classification psychedelic and entactogenic drug of the phenethylamine and amphetamine chemical classes
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Formula C10H13NO2
InChI InChI=1S/C10H13NO2/c1-7(11)4-8-2-3-9-10(5-8)13-6-12-9/h2-3,5,7H,4,6,11H2,1H3
InChIKey NGBBVGZWCFBOGO-UHFFFAOYSA-N
Instrument Name Bio-Rad FTS
SMILES NC(Cc1ccc2OCOc2c1)C
Sample Preparation Procedure The HCl salt was dissolved in 0.5 ml water in a test tube, and 1 drop of 30% NaOH solution was added, causing the clear solution to turn cloudy white. 1 ml dichloromethane was added to the test tube, which was shaken thoroughly using a vortex mixer. The test tube was spun in a centrifuge to separate the organic and aqueous layers. The bottom organic layer was retrieved with a pipette and placed in another clean test tube. Most of the solvent was evaporated from the tube using a flow of nitrogen gas, and the remaining solution was used to create a film on the diamond window for ATR-IR.
Source of Spectrum Forensic Spectral Research
Synonyms (±)-α-Methyl-1,3-benzodioxole-5-ethanamine hydrochloride; (±)-MDA hydrochloride
Technique ATR-Film (MeCl2) (DuraSamplIR II)