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2-Bromo-6-fluorobenzeneboronic acid
SpectraBase Compound ID 3SS9fHkf0ya
InChI InChI=1S/C6H5BBrFO2/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3,10-11H
InChIKey MVSHYHSMIRBRGU-UHFFFAOYSA-N
Mol Weight 218.8 g/mol
Molecular Formula C6H5BBrFO2
Exact Mass 217.955001 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID DYnJBZLrKA5
Name 2-Bromo-6-fluorobenzeneboronic acid
Source of Sample Alfa Aesar, Thermo Fisher Scientific
Catalog Number H53071
Lot Number 81202535
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 0.270609
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 -10688
Backward Peak Location 14480
Beam Splitter Setting KBr
CAS Registry Number 913835-80-0
Color Properties White
Container ID C-009150
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 C6H5BBrFO2
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/C6H5BBrFO2/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3,10-11H
InChIKey MVSHYHSMIRBRGU-UHFFFAOYSA-N
Instrument Name Bruker Tensor 27 FT-IR
KBr Capsule ID K-04579
Laser Wavenumber 15800.5 cm⁻¹
Low Folding Limit 0
Low Frequency Limit 0
Low Pass Filter 10
Molecular Weight 218.816 g/mol
Non Linearity Correction 0
Number of Points 15180
Number of Sample Scans 32
Optical Filter Setting Open
Peak Amplitude -11191
Peak Amplitude 2nd Channel 1
Peak Location 14476
Peak Location 2nd Channel 1
Pellet ID P-04425
Phase Correction Mode Mertz
Phase Resolution 4
Physical State Solid
Preamplifier Gain Background 0
Purity 98%
Relative Humidity Interferometer 10 %
Resolution 2
SKU H53071-1G
SMILES OB(c1c(cccc1F)Br)O
Sample Capsule ID S-04579
Sample Spacing Divisor 1
Sample Spacing Multiplicator 1
Scan Time 50.052 s
Scanner Temperature 30.4 °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 2-Bromo-6-fluorophenylboronic acid
Technique KBr1
Zero Filling Factor 8