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Methylone
SpectraBase Compound ID H1hWCfgAVXD
InChI InChI=1S/C11H13NO3/c1-7(12-2)11(13)8-3-4-9-10(5-8)15-6-14-9/h3-5,7,12H,6H2,1-2H3
InChIKey VKEQBMCRQDSRET-UHFFFAOYSA-N
Mol Weight 207.23 g/mol
Molecular Formula C11H13NO3
Exact Mass 207.089543 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID 1bGm07cgaA7
Name Methylone
Source of Sample Cayman Chemical Company
Catalog Number Free base of 11626
Lot Number Free base of 0491585-1
Accessory DurasamplIR II
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DEA Schedule I
Formula C11H13NO3
IUPAC Name 1-(1,3-Benzodioxol-5-yl)-2-(methylamino)-1-propanone
InChI InChI=1S/C11H13NO3/c1-7(12-2)11(13)8-3-4-9-10(5-8)15-6-14-9/h3-5,7,12H,6H2,1-2H3
InChIKey VKEQBMCRQDSRET-UHFFFAOYSA-N
Instrument Name Bio-Rad FTS
SMILES N(C(C(c1cc2c(cc1)OCO2)=O)C)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.
Scan Speed (number) 5
Solvent Dichloromethane
Source of Spectrum Forensic Spectral Research
Technique ATR-Film