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N,N-Dimethylpentylone
SpectraBase Compound ID GlkPkNusnV1
InChI InChI=1S/C14H19NO3/c1-4-5-11(15(2)3)14(16)10-6-7-12-13(8-10)18-9-17-12/h6-8,11H,4-5,9H2,1-3H3
InChIKey PQTJKFUXRBKONZ-UHFFFAOYSA-N
Mol Weight 249.31 g/mol
Molecular Formula C14H19NO3
Exact Mass 249.136493 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID BCJsP5gtKQz
Name N,N-Dimethylpentylone
Source of Sample Cayman Chemical Company
Catalog Number Free base of 9001933
Lot Number Free base of 0457892-22
Accessory DurasamplIR II
CAS Registry Number 803614-36-0
Classification cathinone derivative shown to have psychostimulant effects, was recently identified as a component of the designer drug mixture, NRG
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Formula C14H19NO3
InChI InChI=1S/C14H19NO3/c1-4-5-11(15(2)3)14(16)10-6-7-12-13(8-10)18-9-17-12/h6-8,11H,4-5,9H2,1-3H3
InChIKey PQTJKFUXRBKONZ-UHFFFAOYSA-N
Instrument Name Bio-Rad FTS
SMILES c1(cc2c(cc1)OCO2)C(C(N(C)C)CCC)=O
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 1-(1,3-Benzodioxol-5-yl)-2-(dimethylamino)-1-pentanone
Technique ATR-Film (MeCl2) (DuraSamplIR II)