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4-CAB
SpectraBase Compound ID 31fJJg48lsz
InChI InChI=1S/C10H14ClN/c1-2-10(12)7-8-3-5-9(11)6-4-8/h3-6,10H,2,7,12H2,1H3
InChIKey BDZUAWTZJXBMLX-UHFFFAOYSA-N
Mol Weight 183.68 g/mol
Molecular Formula C10H14ClN
Exact Mass 183.081477 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID JShRTDbRNLv
Name 4-CAB
Source of Sample Cayman Chemical Company
Catalog Number Free base of 13893
Lot Number Free base of 0445180-25
Accessory DurasamplIR II
Acronyms AEPCA
Apodization Function Triangular
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Formula C10H14ClN
IUPAC Name 4-Chloro-α-ethylbenzeneethanamine
InChI InChI=1S/C10H14ClN/c1-2-10(12)7-8-3-5-9(11)6-4-8/h3-6,10H,2,7,12H2,1H3
InChIKey BDZUAWTZJXBMLX-UHFFFAOYSA-N
Instrument Name Bio-Rad FTS
SMILES NC(Cc1ccc(cc1)Cl)CC
Sample Preparation Comments 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
Synonyms 4-Chlorophenylisobutylamine; 4-Chloro-α-ethylphenethylamine
Technique ATR-Film