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3,4-Trimethylene-α-piperidinovalerophenone
SpectraBase Compound ID 9IzB6odpNac
InChI InChI=1S/C19H27NO/c1-2-7-18(20-12-4-3-5-13-20)19(21)17-11-10-15-8-6-9-16(15)14-17/h10-11,14,18H,2-9,12-13H2,1H3
InChIKey XCBQKBNQNYAXPN-UHFFFAOYSA-N
Mol Weight 285.43 g/mol
Molecular Formula C19H27NO
Exact Mass 285.209264 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID 7mFaT9nUD1H
Name 3,4-Trimethylene-α-piperidinovalerophenone
Source of Sample Cayman Chemical Company
Catalog Number Free base of 37751
Lot Number Free base of 0665044-2
Accessory DurasamplIR II
Apodization Function Norton-Beer, medium
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Formula C19H27NO
InChI InChI=1S/C19H27NO/c1-2-7-18(20-12-4-3-5-13-20)19(21)17-11-10-15-8-6-9-16(15)14-17/h10-11,14,18H,2-9,12-13H2,1H3
InChIKey XCBQKBNQNYAXPN-UHFFFAOYSA-N
Instrument Name Bio-Rad FTS
SMILES c1c(ccc2CCCc12)C(C(N1CCCCC1)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 in the diamond window for ATR-IR.
Solvent Dichloromethane
Source of Spectrum Forensic Spectral Research
Technique ATR-Film