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4-Octanone
SpectraBase Compound ID Aol6FaR3UMm
InChI InChI=1S/C8H16O/c1-3-5-7-8(9)6-4-2/h3-7H2,1-2H3
InChIKey YWXLSHOWXZUMSR-UHFFFAOYSA-N
Mol Weight 128.21 g/mol
Molecular Formula C8H16O
Exact Mass 128.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J7Y4hAgIXd9
Name 4-Octanone
CAS Registry Number 589-63-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H16O
InChI InChI=1S/C8H16O/c1-3-5-7-8(9)6-4-2/h3-7H2,1-2H3
InChIKey YWXLSHOWXZUMSR-UHFFFAOYSA-N
Molecular Weight 128.215 g/mol
SMILES CCCCC(=O)CCC
SPLASH splash10-054x-9000000000-fe5909410dd927e8eb99
Source of Spectrum AA-0-567-1
Synonyms Butyl propyl ketone N-C4H9COCH2CH2CH3 Octan-4-one Propyl butyl ketone Propyl n-butyl ketone EINECS 209-655-9
Wiley ID 5345