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1-(5-Chloro-2-hydroxy-4-methylphenyl)ethanone
SpectraBase Compound ID 2HTIvOls6Wr
InChI InChI=1S/C9H9ClO2/c1-5-3-9(12)7(6(2)11)4-8(5)10/h3-4,12H,1-2H3
InChIKey HDUSGGZSLVCDKY-UHFFFAOYSA-N
Mol Weight 184.62 g/mol
Molecular Formula C9H9ClO2
Exact Mass 184.029107 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID LeRwv1fAvzE
Name 5'-Chloro-2'-hydroxy-4'-methylacetophenone
Source of Sample TCI Chemicals India Pvt. Ltd.
Catalog Number C1629
Lot Number GI01-QJBA
Accessory DuraSample IR #145404C7
Acquisition Mode double sided, forward-backward
Actual Signal Gain 16
Actual Signal Gain 2nd Channel 1
Additional Data Treatment 1
Analog Signal 1 0.270537
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 Rotations 32
Background Scans 32
Background Scans or Time Scans
Backward Peak Amplitude -1484
Backward Peak Location 7348
Beam Splitter Setting KBr
CAS Registry Number 28480-70-8
Container ID C-010237
Copyright Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved.
Data Point Format 1
Delay Before Measurement 1 s
Detector Setting RT-DLaTGS [Internal]
End Frequency Limit for File 340
External Synchronization Off
Focal Length 100
Formula C9H9ClO2
Frequency of First Point 3998.29 cm⁻¹
Frequency of Last Point 339.459 cm⁻¹
High Folding Limit 15800.3
High Frequency Limit 8000 cm⁻¹
High Pass Filter 0
InChI InChI=1S/C9H9ClO2/c1-5-3-9(12)7(6(2)11)4-8(5)10/h3-4,12H,1-2H3
InChIKey HDUSGGZSLVCDKY-UHFFFAOYSA-N
Instrument Name Bruker Tensor 27 FT-IR
Laser Wavenumber 15800.3 cm⁻¹
Low Folding Limit 0
Low Frequency Limit 0
Low Pass Filter 10
Measurement Channel Sample Compartment
Molecular Weight 184.622 g/mol
Non Linearity Correction 0
Number of Points 3795
Number of Sample Scans 32
Optical Filter Setting Open
Peak Amplitude -1438
Peak Amplitude 2nd Channel 1
Peak Location 7388
Peak Location 2nd Channel 1
Phase Correction Mode Mertz
Phase Resolution 8
Physical State Solid
Preamplifier Gain 3
Preamplifier Gain Background 0
Purity >95.0%
Relative Humidity Interferometer 0 %
Resolution 4
SKU C1629-5G
SMILES Oc1cc(c(cc1C(C)=O)Cl)C
Sample Comments Sample ground at metal edge of ATR
Sample Rotations 32
Sample Scans or Time Scans
Sample Spacing Divisor 1
Sample Spacing Multiplicator 1
Scan Time 27.33 s
Scanner Temperature 28.9 °C
Scanner Velocity 10 kHz
Signal Gain, Background automatic
Signal Gain, Sample automatic
Source of Spectrum Bio-Rad Laboratories, Inc.
Start Frequency Limit for File 4000 cm⁻¹
Synonyms 4-Acetyl-2-chloro-5-hydroxytoluene; 1-(5-Chloro-2-hydroxy-4-methylphenyl)ethanone
Technique ATR-Neat
Zero Filling Factor 4