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4,5-Octanedione
SpectraBase Compound ID HCh1Sk1lMF8
InChI InChI=1S/C8H14O2/c1-3-5-7(9)8(10)6-4-2/h3-6H2,1-2H3
InChIKey XYZAPOXYXNIBEU-UHFFFAOYSA-N
Mol Weight 142.2 g/mol
Molecular Formula C8H14O2
Exact Mass 142.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K6olAmGqRxe
Name 4,5-Octanedione
CAS Registry Number 5455-24-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H14O2
InChI InChI=1S/C8H14O2/c1-3-5-7(9)8(10)6-4-2/h3-6H2,1-2H3
InChIKey XYZAPOXYXNIBEU-UHFFFAOYSA-N
Molecular Weight 142.198 g/mol
SMILES CCCC(C(=O)CCC)=O
SPLASH splash10-006x-9000000000-0756916ddb6519b1e4a1
Source of Spectrum AD-0-2048-0
Synonyms 4,5-Octadione Octane-4,5-dione Bibutyryl n-Octane-4,5-dione Octan-4,5-dione
Wiley ID 8246