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Methyl 5-bromo-2-methylbenzoate
SpectraBase Compound ID 5F8ChmBj0tZ
InChI InChI=1S/C9H9BrO2/c1-6-3-4-7(10)5-8(6)9(11)12-2/h3-5H,1-2H3
InChIKey FDCYLMYCHALQJR-UHFFFAOYSA-N
Mol Weight 229.07 g/mol
Molecular Formula C9H9BrO2
Exact Mass 227.978593 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID EJbrDriZq4c
Name Methyl 5-bromo-2-methylbenzoate
Source of Sample TCI Chemicals India Pvt. Ltd.
Catalog Number M2542
Lot Number 4NAXN-EC
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 1562
Backward Peak Location 28691
Beam Splitter Setting Quartz
CAS Registry Number 79669-50-4
Calibration Lamp Spectrum Correction.0
Color Properties White
Container ID C-009434
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 C9H9BrO2
Frequency of First Point 3597.8 cm⁻¹
Frequency of Last Point -1.29183 cm⁻¹
High Folding Limit 31596.8
High Frequency Limit 30000 cm⁻¹
High Pass Filter 1
InChI InChI=1S/C9H9BrO2/c1-6-3-4-7(10)5-8(6)9(11)12-2/h3-5H,1-2H3
InChIKey FDCYLMYCHALQJR-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 229.073 g/mol
Non Linearity Correction 0
Number of Points 7466
Number of Sample Scans 42
Optical Filter Setting Open
Peak Amplitude 1523
Peak Location 28692
Phase Correction Mode power spectrum
Phase Resolution 1
Physical State Solid
Preamplifier Gain 0
Purity 98%
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 M2542-1G
SMILES c1c(c(ccc1Br)C)C(OC)=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 5-Bromo-2-methylbenzoic acid methyl ester; 5-Bromo-o-toluic acid methyl ester
Technique FT-Raman
Zero Filling Factor 4