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2-Chloro-6-nitro-4-(trifluoromethyl)aniline
SpectraBase Compound ID KLGuG7SW49W
InChI InChI=1S/C7H4ClF3N2O2/c8-4-1-3(7(9,10)11)2-5(6(4)12)13(14)15/h1-2H,12H2
InChIKey JLWRJMVXRUKFPA-UHFFFAOYSA-N
Mol Weight 240.57 g/mol
Molecular Formula C7H4ClF3N2O2
Exact Mass 239.99134 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID JWj5fjFg5w0
Name 2-Chloro-6-nitro-4-(trifluoromethyl)aniline
Source of Sample Alfa Aesar, Thermo Fisher Scientific
Catalog Number B20938
Lot Number 10143712
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 0.270464
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 32
Background Scans or Time Scans
Backward Peak Amplitude -10900
Backward Peak Location 14479
Beam Splitter Setting KBr
CAS Registry Number 57729-79-0
Color Properties Yellow
Container ID C-009893
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 C7H4ClF3N2O2
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/C7H4ClF3N2O2/c8-4-1-3(7(9,10)11)2-5(6(4)12)13(14)15/h1-2H,12H2
InChIKey JLWRJMVXRUKFPA-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 240.569 g/mol
Non Linearity Correction 0
Number of Points 15180
Number of Sample Scans 32
Optical Filter Setting Open
Peak Amplitude -10776
Peak Amplitude 2nd Channel 1
Peak Location 14476
Peak Location 2nd Channel 1
Phase Correction Mode Mertz
Phase Resolution 4
Physical State Solid
Preamplifier Gain Background 0
Purity 97%
Relative Humidity Interferometer 10 %
Resolution 2
SKU B20938-1G
SMILES C(F)(F)(F)c1cc(c(c(c1)N(=O)=O)N)Cl
Sample Spacing Divisor 1
Sample Spacing Multiplicator 1
Scan Time 50.044 s
Scanner Temperature 29.2 °C
Scanner Velocity 10 kHz
Signal Gain, Background automatic
Solvent Dichloromethane
Source of Spectrum Bio-Rad Laboratories, Inc.
Start Frequency Limit for File 4000 cm⁻¹
Synonyms 4-Amino-3-chloro-5-nitrobenzotrifluoride
Technique Film
Window KBr Window
Zero Filling Factor 8