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trans-1,4-Cyclohexanedicarboxylic acid
SpectraBase Compound ID Ja5QtPeErj5
InChI InChI=1S/C8H12O4/c9-7(10)5-1-2-6(4-3-5)8(11)12/h5-6H,1-4H2,(H,9,10)(H,11,12)/t5-,6-
InChIKey PXGZQGDTEZPERC-IZLXSQMJSA-N
Mol Weight 172.18 g/mol
Molecular Formula C8H12O4
Exact Mass 172.073559 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID KFtFm4JdFy
Name trans-1,4-Cyclohexanedicarboxylic acid
Source of Sample Alfa Aesar, Thermo Fisher Scientific
Catalog Number H60089
Lot Number 81202555
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 2172
Backward Peak Location 28691
Beam Splitter Setting Quartz
CAS Registry Number 619-82-9
Calibration Lamp Spectrum Correction.0
Container ID C-009770
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 C8H12O4
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/C8H12O4/c9-7(10)5-1-2-6(4-3-5)8(11)12/h5-6H,1-4H2,(H,9,10)(H,11,12)/t5-,6-
InChIKey PXGZQGDTEZPERC-IZLXSQMJSA-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 172.180 g/mol
Non Linearity Correction 0
Number of Points 7466
Number of Sample Scans 68
Optical Filter Setting Open
Peak Amplitude 2138
Peak Location 28693
Phase Correction Mode power spectrum
Phase Resolution 1
Physical State Solid
Preamplifier Gain 0
Purity 95%
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 H60089-1G
SMILES OC([C@]1(CC[C@](C(O)=O)(CC1)[H])[H])=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
Technique FT-Raman
Zero Filling Factor 4