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alpha'-Chloro-alpha,alpha,alpha-trifluoro-m-xylene
SpectraBase Compound ID 116GXpO0CgT
InChI InChI=1S/C8H6ClF3/c9-5-6-2-1-3-7(4-6)8(10,11)12/h1-4H,5H2
InChIKey XGASTRVQNVVYIZ-UHFFFAOYSA-N
Mol Weight 194.58 g/mol
Molecular Formula C8H6ClF3
Exact Mass 194.011012 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 2w2IxqUSL9P
Name 3-(Trifluoromethyl)benzyl chloride
Source of Sample TCI Chemicals India Pvt. Ltd.
Catalog Number T2290
Lot Number DNB4M-PS
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 0.270541
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 -6803
Backward Peak Location 14479
Beam Splitter Setting KBr
CAS Registry Number 705-29-3
Color Properties Light yellow
Container ID C-010111
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 C8H6ClF3
Frequency of First Point 3999.76 cm⁻¹
Frequency of Last Point 339.943 cm⁻¹
High Folding Limit 15800.4
High Frequency Limit 8000 cm⁻¹
High Pass Filter 0
InChI InChI=1S/C8H6ClF3/c9-5-6-2-1-3-7(4-6)8(10,11)12/h1-4H,5H2
InChIKey XGASTRVQNVVYIZ-UHFFFAOYSA-N
Instrument Name Bruker Tensor 27 FT-IR
Laser Wavenumber 15800.4 cm⁻¹
Low Folding Limit 0
Low Frequency Limit 0
Low Pass Filter 10
Molecular Weight 194.584 g/mol
Non Linearity Correction 0
Number of Points 15181
Number of Sample Scans 32
Optical Filter Setting Open
Peak Amplitude -6998
Peak Amplitude 2nd Channel 1
Peak Location 14477
Peak Location 2nd Channel 1
Phase Correction Mode Mertz
Phase Resolution 4
Preamplifier Gain Background 0
Purity >95.0%
Relative Humidity Interferometer 20 %
Resolution 2
SKU T2290-5G
SMILES C(F)(F)(F)c1cc(ccc1)CCl
Sample Spacing Divisor 1
Sample Spacing Multiplicator 1
Scan Time 50.059 s
Scanner Temperature 29.6 °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-(Chloromethyl)benzotrifluoride; α-Chloro-α',α',α'-trifluoro-m-xylene
Technique Neat
Window KBr Window - 2 Side
Zero Filling Factor 8