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Isopropyl 3-acetylpyridine-2-carboxylate
SpectraBase Compound ID 419zWEDl1i9
InChI InChI=1S/C11H13NO3/c1-7(2)15-11(14)10-9(8(3)13)5-4-6-12-10/h4-7H,1-3H3
InChIKey KTGMAKWQZOTIDD-UHFFFAOYSA-N
Mol Weight 207.23 g/mol
Molecular Formula C11H13NO3
Exact Mass 207.089543 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID A1TU5HXR8Ls
Name Isopropyl 3-acetylpyridine-2-carboxylate
Source of Sample Alfa Aesar, Thermo Fisher Scientific
Catalog Number L13583
Lot Number FA019503
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 0.27052
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 -11111
Backward Peak Location 14481
Beam Splitter Setting KBr
CAS Registry Number 195812-68-1
Color Properties White
Container ID C-008913
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 C11H13NO3
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/C11H13NO3/c1-7(2)15-11(14)10-9(8(3)13)5-4-6-12-10/h4-7H,1-3H3
InChIKey KTGMAKWQZOTIDD-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 207.229 g/mol
Non Linearity Correction 0
Number of Points 15180
Number of Sample Scans 32
Optical Filter Setting Open
Peak Amplitude -10886
Peak Amplitude 2nd Channel 1
Peak Location 14474
Peak Location 2nd Channel 1
Phase Correction Mode Mertz
Phase Resolution 4
Physical State Liquid
Preamplifier Gain Background 0
Purity 97%
Relative Humidity Interferometer 10 %
Resolution 2
SKU L13583-5G
SMILES c1c(c(ncc1)C(OC(C)C)=O)C(C)=O
Sample Spacing Divisor 1
Sample Spacing Multiplicator 1
Scan Time 50.064 s
Scanner Temperature 28.9 °C
Scanner Velocity 10 kHz
Signal Gain, Background automatic
Source of Spectrum Bio-Rad Laboratories, Inc.
Start Frequency Limit for File 4000 cm⁻¹
Synonyms 3-Acetylpyridine-2-carboxylic acid isopropyl ester; Isopropyl 3-acetylpicolinate
Technique Melt (Liquid)
Window KBr Window
Zero Filling Factor 8