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Butanal
SpectraBase Compound ID 5ki3vFX5rAC
InChI InChI=1S/C4H8O/c1-2-3-4-5/h4H,2-3H2,1H3
InChIKey ZTQSAGDEMFDKMZ-UHFFFAOYSA-N
Mol Weight 72.11 g/mol
Molecular Formula C4H8O
Exact Mass 72.057515 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GKNLwG3FIsX
Name Butyraldehyde, 2TMS, 1MEOX
Comments Non-derivatized structure shown; Derivatization type: 2 TMS (mass: 245.163); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib000094; Note: The molecular formula of the structure shown is C4H8O - which differs from the formula reported for the mass spectrum (C11H27NOSi2)
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Formula C11H27NOSi2
InChI InChI=1S/C4H8O/c1-2-3-4-5/h4H,2-3H2,1H3
InChIKey ZTQSAGDEMFDKMZ-UHFFFAOYSA-N
Molecular Weight 72.107 g/mol
SMILES CCCC=O
SPLASH splash10-0002-2900000000-83b600ab32dca908e89f
Source of Spectrum FM-2019-94-0
Synonyms Butanal, 2TMS, 1MEOX n-butyraldehyde, 2TMS, 1MEOX Butanaldehyde, 2TMS, 1MEOX Butaldehyde, 2TMS, 1MEOX Butalyde, 2TMS, 1MEOX Butanal, 2TMS, 1MEOX Butyraldehyde
Wiley ID 1817788