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5-Fluoro-2-(trifluoromethyl)phenylacetic acid
SpectraBase Compound ID 6IbSFo7y6m9
InChI InChI=1S/C9H6F4O2/c10-6-1-2-7(9(11,12)13)5(3-6)4-8(14)15/h1-3H,4H2,(H,14,15)
InChIKey GWWZRGDMAFXULO-UHFFFAOYSA-N
Mol Weight 222.14 g/mol
Molecular Formula C9H6F4O2
Exact Mass 222.030392 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID EnzpHhQSjdm
Name 5-Fluoro-2-(trifluoromethyl)phenylacetic acid
Source of Sample Alfa Aesar, Thermo Fisher Scientific
Catalog Number H26696
Lot Number 10137784
Acquisition Mode double sided, forward-backward
Actual Signal Gain 2
Additional Data Treatment 1
Aperture Setting 2.5 mm
Apodization Function Norton-Beer, medium
Backward Peak Amplitude 2397
Backward Peak Location 28687
Beam Splitter Setting Quartz
CAS Registry Number 239135-52-5
Calibration Lamp Spectrum Correction.0
Color Properties White
Container ID C-009910
Copyright Copyright © 2017-2024 John Wiley & Sons, Inc. All Rights Reserved.
Data Point Format 1
Delay Before Measurement 15 s
Detector Setting LN-Ge Diode [Internal Pos.2]
End Frequency Limit for File 9394.3
External Analog Signals Off
External Synchronization Off
Focal Length 100
Formula C9H6F4O2
Frequency of First Point 3597.79 cm⁻¹
Frequency of Last Point -1.31092 cm⁻¹
High Folding Limit 31596.8
High Frequency Limit 30000 cm⁻¹
High Pass Filter 1
InChI InChI=1S/C9H6F4O2/c10-6-1-2-7(9(11,12)13)5(3-6)4-8(14)15/h1-3H,4H2,(H,14,15)
InChIKey GWWZRGDMAFXULO-UHFFFAOYSA-N
Instrument Name Bruker MultiRAM Stand Alone FT-Raman Spectrometer
Laser Wavenumber 15798.4 cm⁻¹
Low Folding Limit 0
Low Frequency Limit 0
Low Pass Filter 5
Measurement Channel Raman Compartment
Molecular Weight 222.139 g/mol
Non Linearity Correction 0
Number of Points 7466
Number of Sample Scans 246
Optical Filter Setting Open
Peak Amplitude -2307
Peak Location 28693
Phase Correction Mode power spectrum
Phase Resolution 1
Physical State Liquid
Preamplifier Gain 0
Purity 97%
Raman Background Corrected Yes
Raman Corrections Referenced to internal light source; Scattering corrected
Raman Laser Source Nd:YAG
Raman Scattering Corrected Yes
Resolution 2
SKU H26696-1G
SMILES C(F)(F)(F)c1c(CC(O)=O)cc(cc1)F
Sample Scans or Time Scans
Sample Spacing Divisor 1
Sample Spacing Multiplicator 2
Scan Time 0 s
Scanner Velocity 5 kHz
Signal Gain, Sample 2
Source of Spectrum Bio-Rad Laboratories, Inc.
Start Frequency Limit for File 5794.76 cm⁻¹
Technique FT-Raman
Zero Filling Factor 4