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Isobutyric acid
SpectraBase Compound ID LMcJonduA4
InChI InChI=1S/C4H8O2/c1-3(2)4(5)6/h3H,1-2H3,(H,5,6)
InChIKey KQNPFQTWMSNSAP-UHFFFAOYSA-N
Mol Weight 88.11 g/mol
Molecular Formula C4H8O2
Exact Mass 88.052429 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HYdmiO3k1W8
Name Isobutyric acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C4H8O2
InChI InChI=1S/C4H8O2/c1-3(2)4(5)6/h3H,1-2H3,(H,5,6)
InChIKey KQNPFQTWMSNSAP-UHFFFAOYSA-N
Instrument Name Shimadzu GC-2010 plus or Shimadzu GCMS-QP2010
Ionization Type EI
Literature Reference DOI 10.1002/cjoc.202100576
Molecular Weight 88.106 g/mol
SMILES OC(C(C)C)=O
SPLASH splash10-0006-9000000000-ced815e2ad920f8c1f44
Source of Spectrum CJC-40-SM13-Figure S12-c
Wiley ID 1871817