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4-Hydroxy-3-nitrobenzonitrile
SpectraBase Compound ID CwlypQPjL8n
InChI InChI=1S/C7H4N2O3/c8-4-5-1-2-7(10)6(3-5)9(11)12/h1-3,10H
InChIKey INBLGVOPOSGVTA-UHFFFAOYSA-N
Mol Weight 164.12 g/mol
Molecular Formula C7H4N2O3
Exact Mass 164.022192 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID AzJEs5Cosxe
Name 4-Hydroxy-3-nitrobenzonitrile
Source of Sample Alfa Aesar, Thermo Fisher Scientific
Catalog Number H55597
Lot Number 5005R19Q
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 4947
Backward Peak Location 28687
Beam Splitter Setting Quartz
CAS Registry Number 3272-08-0
Calibration Lamp Spectrum Correction.0
Color Properties Yellow to pale brown
Container ID C-009964
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 C7H4N2O3
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/C7H4N2O3/c8-4-5-1-2-7(10)6(3-5)9(11)12/h1-3,10H
InChIKey INBLGVOPOSGVTA-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 164.120 g/mol
Non Linearity Correction 0
Number of Points 7466
Number of Sample Scans 256
Optical Filter Setting Open
Peak Amplitude -4832
Peak Location 28693
Phase Correction Mode power spectrum
Phase Resolution 1
Physical State Solid
Preamplifier Gain 0
Purity 98%
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 H55597-1G
SMILES Oc1ccc(cc1N(=O)=O)C#N
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
Synonyms 4-Cyano-2-nitrophenol
Technique FT-Raman
Zero Filling Factor 4