For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
4-Nitronicotinic acid N-oxide
SpectraBase Compound ID 2SXdspatLLH
InChI InChI=1S/C6H4N2O5/c9-6(10)4-3-7(11)2-1-5(4)8(12)13/h1-3H,(H,9,10)
InChIKey OYLXIYDCLHUDQV-UHFFFAOYSA-N
Mol Weight 184.11 g/mol
Molecular Formula C6H4N2O5
Exact Mass 184.012021 g/mol

Raman Spectrum

Raman Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 6fysEN6UG0L
Name 4-Nitronicotinic acid N-oxide
Source of Sample Alfa Aesar, Thermo Fisher Scientific
Catalog Number L20049
Lot Number 10123830
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 4062
Backward Peak Location 28691
Beam Splitter Setting Quartz
CAS Registry Number 1078-05-3
Calibration Lamp Spectrum Correction.0
Color Properties Cream
Container ID C-009903
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 C6H4N2O5
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/C6H4N2O5/c9-6(10)4-3-7(11)2-1-5(4)8(12)13/h1-3H,(H,9,10)
InChIKey OYLXIYDCLHUDQV-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 184.107 g/mol
Non Linearity Correction 0
Number of Points 7466
Number of Sample Scans 254
Optical Filter Setting Open
Peak Amplitude 3901
Peak Location 28692
Phase Correction Mode power spectrum
Phase Resolution 1
Physical State Solid
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 L20049-1G
SMILES OC(c1c(cc[n+](c1)[O-])N(=O)=O)=O
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-Nitropyridine-3-carboxylic acid N-oxide
Technique FT-Raman
Zero Filling Factor 4