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4-Bromo-2-nitrotoluene
SpectraBase Compound ID LisxV7od09c
InChI InChI=1S/C7H6BrNO2/c1-5-2-3-6(8)4-7(5)9(10)11/h2-4H,1H3
InChIKey KZNXALJXBRSMFL-UHFFFAOYSA-N
Mol Weight 216.03 g/mol
Molecular Formula C7H6BrNO2
Exact Mass 214.958191 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID ERIL5gasEwv
Name 4-Bromo-2-nitrotoluene
Source of Sample Acros Organics
Catalog Number 276210010
Lot Number A0301593
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 0.270403
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 -12179
Backward Peak Location 14449
Beam Splitter Setting KBr
CAS Registry Number 60956-26-5
Color Properties Yellow to light orange
Container ID C-008408
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 C7H6BrNO2
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/C7H6BrNO2/c1-5-2-3-6(8)4-7(5)9(10)11/h2-4H,1H3
InChIKey KZNXALJXBRSMFL-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 216.034 g/mol
Non Linearity Correction 0
Number of Points 15180
Number of Sample Scans 32
Optical Filter Setting Open
Peak Amplitude -11724
Peak Amplitude 2nd Channel 1
Peak Location 14507
Peak Location 2nd Channel 1
Phase Correction Mode Mertz
Phase Resolution 4
Physical State Solid
Preamplifier Gain Background 0
Purity 98%
Relative Humidity Interferometer 20 %
Resolution 2
SKU 276210010-1GR
SMILES N(=O)(=O)c1cc(ccc1C)Br
Sample Spacing Divisor 1
Sample Spacing Multiplicator 1
Scan Time 50.046 s
Scanner Temperature 27.4 °C
Scanner Velocity 10 kHz
Signal Gain, Background automatic
Source of Spectrum Bio-Rad Laboratories, Inc.
Start Frequency Limit for File 4000 cm⁻¹
Technique Melt (Liquid)
Window KBr Window
Zero Filling Factor 8