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3-(Trifluoromethyl)phenethylamine
SpectraBase Compound ID 3ZAzNqp4Cdb
InChI InChI=1S/C9H10F3N/c10-9(11,12)8-3-1-2-7(6-8)4-5-13/h1-3,6H,4-5,13H2
InChIKey BPVYCXMGJPKOTQ-UHFFFAOYSA-N
Mol Weight 189.18 g/mol
Molecular Formula C9H10F3N
Exact Mass 189.076534 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID JoemK9v0lfH
Name 2-[3-(Trifluoromethyl)phenyl]ethylamine
Source of Sample Alfa Aesar, Thermo Fisher Scientific
Catalog Number H64084
Lot Number M06D003
Accessory TRANS *14560FA0
Acquisition Mode double sided, forward-backward
Actual Signal Gain 2
Actual Signal Gain 2nd Channel 1
Additional Data Treatment 0
Analog Signal 1 0.270507
Analog Signal 2 0
Aperture Setting 6 mm
Apodization Function Norton-Beer, medium
Background Measurement Channel Sample Compartment
Background Peak Amplitude 2nd Channel 1
Background Peak Location 2nd Channel 1
Background Scans 16
Background Scans or Time Scans
Backward Peak Amplitude -11634
Backward Peak Location 14449
Beam Splitter Setting KBr
CAS Registry Number 52516-30-0
Container ID C-009979
Copyright Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved.
Data Point Format 1
Delay Before Measurement 0 s
Detector Setting RT-DLaTGS [Internal]
End Frequency Limit for File 340
External Synchronization Off
Focal Length 100
Formula C9H10F3N
Frequency of First Point 3999.54 cm⁻¹
Frequency of Last Point 339.945 cm⁻¹
High Folding Limit 15800.5
High Frequency Limit 8000 cm⁻¹
High Pass Filter 0
InChI InChI=1S/C9H10F3N/c10-9(11,12)8-3-1-2-7(6-8)4-5-13/h1-3,6H,4-5,13H2
InChIKey BPVYCXMGJPKOTQ-UHFFFAOYSA-N
Instrument Name Bruker Tensor 27 FT-IR
Laser Wavenumber 15800.5 cm⁻¹
Low Folding Limit 0
Low Frequency Limit 0
Low Pass Filter 10
Molecular Weight 189.181 g/mol
Non Linearity Correction 0
Number of Points 15180
Number of Sample Scans 16
Optical Filter Setting Open
Peak Amplitude -11531
Peak Amplitude 2nd Channel 1
Peak Location 14506
Peak Location 2nd Channel 1
Phase Correction Mode Mertz
Phase Resolution 4
Physical State Liquid
Preamplifier Gain Background 0
Purity 98%
Relative Humidity Interferometer 10 %
Resolution 2
SKU H64084-1G
SMILES NCCc1cc(ccc1)C(F)(F)F
Sample Spacing Divisor 1
Sample Spacing Multiplicator 1
Scan Time 24.988 s
Scanner Temperature 28.5 °C
Scanner Velocity 10 kHz
Signal Gain, Background automatic
Source of Spectrum Bio-Rad Laboratories, Inc.
Start Frequency Limit for File 4000 cm⁻¹
Synonyms 3-(Trifluoromethyl)phenethylamine
Technique Neat
Window KBr Window - 1 Side
Zero Filling Factor 8