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4-Methylvaleric acid
SpectraBase Compound ID 4ZJkwL291Nk
InChI InChI=1S/C6H12O2/c1-5(2)3-4-6(7)8/h5H,3-4H2,1-2H3,(H,7,8)
InChIKey FGKJLKRYENPLQH-UHFFFAOYSA-N
Mol Weight 116.16 g/mol
Molecular Formula C6H12O2
Exact Mass 116.08373 g/mol

Near Infrared (NIR) Spectrum

Near Infrared (NIR) Spectrum

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SpectraBase Spectrum ID Ex1zGXnoYBU
Name Pentanoic acid, 4-methyl-
Comments Window Material: QI
Copyright Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C6H12O2
InChI InChI=1S/C6H12O2/c1-5(2)3-4-6(7)8/h5H,3-4H2,1-2H3,(H,7,8)
InChIKey FGKJLKRYENPLQH-UHFFFAOYSA-N
Instrument Name INSTRUMENT PARAMETERS=INST=BRUKER,RSN=3647,REO=2,CNM=HEI,ZFF=2
Purity 98%
Sample Description STATE=NEAT, LIQUID
Source of Spectrum Prof. Buback, University of Goettingen, Germany
Technique NIR Spectrometer= BRUKER IFS 88