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5-(2-Ethoxyphenyl)-1-methyl-3-propyl-1,6-dihydro-7H-pyrazolo[4,3-d]-7-pyrimidinone
SpectraBase Compound ID rA5vxssVR7
InChI InChI=1S/C17H20N4O2/c1-4-8-12-14-15(21(3)20-12)17(22)19-16(18-14)11-9-6-7-10-13(11)23-5-2/h6-7,9-10H,4-5,8H2,1-3H3,(H,18,19,22)
InChIKey MXQUEDUMKWBYHI-UHFFFAOYSA-N
Mol Weight 312.37 g/mol
Molecular Formula C17H20N4O2
Exact Mass 312.158626 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID FE76PVk7wQW
Name 5-(2-Ethoxyphenyl)-1-methyl-3-propyl-1,6-dihydro-7H-pyrazolo[4,3-d]-7-pyrimidinone
Source of Sample TCI Chemicals India Pvt. Ltd.
Catalog Number E1134
Lot Number 67GUB-QA
Acquisition Mode double sided, forward-backward
Actual Signal Gain 1
Actual Signal Gain 2nd Channel 1
Additional Data Treatment 1
Analog Signal 1 0.222544
Analog Signal 2 0
Aperture Setting 2.5 mm
Apodization Function Norton-Beer, medium
Background Peak Amplitude 2nd Channel 1
Background Peak Location 2nd Channel 1
Backward Peak Amplitude 8909
Backward Peak Location 28687
Beam Splitter Setting Quartz
CAS Registry Number 139756-21-1
Calibration Lamp Spectrum Correction.0
Color Properties Off-white
Container ID C-010451
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 C17H20N4O2
Frequency of First Point 3597.77 cm⁻¹
Frequency of Last Point -0.855506 cm⁻¹
High Folding Limit 31596.9
High Frequency Limit 30000 cm⁻¹
High Pass Filter 1
InChI InChI=1S/C17H20N4O2/c1-4-8-12-14-15(21(3)20-12)17(22)19-16(18-14)11-9-6-7-10-13(11)23-5-2/h6-7,9-10H,4-5,8H2,1-3H3,(H,18,19,22)
InChIKey MXQUEDUMKWBYHI-UHFFFAOYSA-N
Instrument Name Bruker MultiRAM Stand Alone FT-Raman Spectrometer
Laser Wavenumber 15798.5 cm⁻¹
Low Folding Limit 0
Low Frequency Limit 0
Low Pass Filter 5
Measurement Channel Raman Compartment
Molecular Weight 312.373 g/mol
Non Linearity Correction 0
Number of Points 7465
Number of Sample Scans 256
Optical Filter Setting Open
Peak Amplitude 8638
Peak Amplitude 2nd Channel 1
Peak Location 28697
Peak Location 2nd Channel 1
Phase Correction Mode power spectrum
Phase Resolution 1
Physical State Solid
Preamplifier Gain 0
Purity >98.0%
Raman Background Corrected Yes
Raman Corrections Referenced to internal light source; Scattering corrected
Raman Laser Source Nd:YAG
Raman Scattering Corrected Yes
Relative Humidity Interferometer 40 %
Resolution 2
SKU E1134-5G
SMILES N1\C(=N/C(c2[n](nc(c12)CCC)C)=O)c1c(cccc1)OCC
Sample Scans or Time Scans
Sample Spacing Divisor 1
Sample Spacing Multiplicator 2
Scan Time 794.703 s
Scanner Temperature 25.1 °C
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
Temperature of Calibration Lamp 2300
Zero Filling Factor 4