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3-Bromo-4-fluorophenylacetic acid
SpectraBase Compound ID 5nehl3H56ze
InChI InChI=1S/C8H6BrFO2/c9-6-3-5(4-8(11)12)1-2-7(6)10/h1-3H,4H2,(H,11,12)
InChIKey XXFGIJYSXNXNAU-UHFFFAOYSA-N
Mol Weight 233.04 g/mol
Molecular Formula C8H6BrFO2
Exact Mass 231.953521 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 3zstRU2UFLK
Name 3-Bromo-4-fluorophenylacetic acid
Source of Sample Alfa Aesar, Thermo Fisher Scientific
Catalog Number H63622
Lot Number 81301634
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 0.270502
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 -9293
Backward Peak Location 14490
Beam Splitter Setting KBr
CAS Registry Number 194019-11-9
Color Properties Off-white
Container ID C-009275
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 C8H6BrFO2
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/C8H6BrFO2/c9-6-3-5(4-8(11)12)1-2-7(6)10/h1-3H,4H2,(H,11,12)
InChIKey XXFGIJYSXNXNAU-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 233.036 g/mol
Non Linearity Correction 0
Number of Points 15180
Number of Sample Scans 32
Optical Filter Setting Open
Peak Amplitude -8899
Peak Amplitude 2nd Channel 1
Peak Location 14466
Peak Location 2nd Channel 1
Phase Correction Mode Mertz
Phase Resolution 4
Physical State Solid
Preamplifier Gain Background 0
Purity 96%
Relative Humidity Interferometer 0 %
Resolution 2
SKU H63622-1G
SMILES OC(Cc1cc(c(cc1)F)Br)=O
Sample Spacing Divisor 1
Sample Spacing Multiplicator 1
Scan Time 50.047 s
Scanner Temperature 29.3 °C
Scanner Velocity 10 kHz
Signal Gain, Background automatic
Source of Spectrum Bio-Rad Laboratories, Inc.
Start Frequency Limit for File 4000 cm⁻¹
Technique KBr0
Zero Filling Factor 8