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N-Cyclohexyl butylone
SpectraBase Compound ID 2SCiHBh6hig
InChI InChI=1S/C17H23NO3/c1-2-14(18-13-6-4-3-5-7-13)17(19)12-8-9-15-16(10-12)21-11-20-15/h8-10,13-14,18H,2-7,11H2,1H3
InChIKey JUIRPSMGWVYMJT-UHFFFAOYSA-N
Mol Weight 289.37 g/mol
Molecular Formula C17H23NO3
Exact Mass 289.167794 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID 2sFZ58vAJDu
Name N-Cyclohexyl butylone
Source of Sample Cayman Chemical Company
Catalog Number Free base of 36884
Lot Number Free base of 0646340-18
Accessory DurasamplIR II
Apodization Function Norton-Beer, medium
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Formula C17H23NO3
InChI InChI=1S/C17H23NO3/c1-2-14(18-13-6-4-3-5-7-13)17(19)12-8-9-15-16(10-12)21-11-20-15/h8-10,13-14,18H,2-7,11H2,1H3
InChIKey JUIRPSMGWVYMJT-UHFFFAOYSA-N
Instrument Name Bio-Rad FTS
SMILES N(C(C(c1ccc2c(c1)OCO2)=O)CC)C1CCCCC1
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 in the diamond window for ATR-IR.
Solvent Dichloromethane
Source of Spectrum Forensic Spectral Research
Technique ATR-Film