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Benzyl fentanyl
SpectraBase Compound ID 9GY3Q15CO8s
InChI InChI=1S/C21H26N2O/c1-2-21(24)23(19-11-7-4-8-12-19)20-13-15-22(16-14-20)17-18-9-5-3-6-10-18/h3-12,20H,2,13-17H2,1H3
InChIKey POQDXIFVWVZVML-UHFFFAOYSA-N
Mol Weight 322.45 g/mol
Molecular Formula C21H26N2O
Exact Mass 322.204513 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID 7fyfwllCFM3
Name Benzyl fentanyl
Source of Sample Cayman Chemical Company
Catalog Number Free base of 36640
Lot Number Free base of 0641068-2
Accessory DurasamplIR II
Apodization Function Norton-Beer, medium
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Formula C21H26N2O
InChI InChI=1S/C21H26N2O/c1-2-21(24)23(19-11-7-4-8-12-19)20-13-15-22(16-14-20)17-18-9-5-3-6-10-18/h3-12,20H,2,13-17H2,1H3
InChIKey POQDXIFVWVZVML-UHFFFAOYSA-N
Instrument Name Bio-Rad FTS
SMILES C(C(N(C1CCN(CC1)Cc1ccccc1)c1ccccc1)=O)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 in the diamond window for ATR-IR.
Solvent Dichloromethane
Source of Spectrum Forensic Spectral Research
Technique ATR-Film