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2-bromo-3-methylbutyric acid, ethyl ester
SpectraBase Compound ID BPtoI4kVORk
InChI InChI=1S/C7H13BrO2/c1-4-10-7(9)6(8)5(2)3/h5-6H,4H2,1-3H3
InChIKey WNFUWONOILPKNX-UHFFFAOYSA-N
Mol Weight 209.08 g/mol
Molecular Formula C7H13BrO2
Exact Mass 208.009893 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID FPZP3m2hntC
Name Ethyl 2-bromoisovalerate
Source of Sample TCI Chemicals India Pvt. Ltd.
Catalog Number E0969
Lot Number RVFOC-EE
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 0.270609
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 -8764
Backward Peak Location 14462
Beam Splitter Setting KBr
CAS Registry Number 609-12-1
Color Properties Colorless
Container ID C-010107
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 C7H13BrO2
Frequency of First Point 3999.74 cm⁻¹
Frequency of Last Point 339.942 cm⁻¹
High Folding Limit 15800.3
High Frequency Limit 8000 cm⁻¹
High Pass Filter 0
InChI InChI=1S/C7H13BrO2/c1-4-10-7(9)6(8)5(2)3/h5-6H,4H2,1-3H3
InChIKey WNFUWONOILPKNX-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
Molecular Weight 209.083 g/mol
Non Linearity Correction 0
Number of Points 15181
Number of Sample Scans 32
Optical Filter Setting Open
Peak Amplitude -8360
Peak Amplitude 2nd Channel 1
Peak Location 14494
Peak Location 2nd Channel 1
Phase Correction Mode Mertz
Phase Resolution 4
Physical State Liquid
Preamplifier Gain Background 0
Purity >98.0%
Relative Humidity Interferometer 20 %
Resolution 2
SKU E0969-5G
SMILES CC(C(C(OCC)=O)Br)C
Sample Spacing Divisor 1
Sample Spacing Multiplicator 1
Scan Time 50.065 s
Scanner Temperature 29.6 °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 2-Bromoisovaleric acid ethyl ester; Ethyl 2-bromo-3-methylbutyrate
Technique Neat
Window KBr Window - 1 Side
Zero Filling Factor 8