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2-Octanone
SpectraBase Compound ID 5Fi5udRTGZ7
InChI InChI=1S/C8H16O/c1-3-4-5-6-7-8(2)9/h3-7H2,1-2H3
InChIKey ZPVFWPFBNIEHGJ-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 ETOQhojOQ9W
Name 2-Octanone
CAS Registry Number 111-13-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H16O
InChI InChI=1S/C8H16O/c1-3-4-5-6-7-8(2)9/h3-7H2,1-2H3
InChIKey ZPVFWPFBNIEHGJ-UHFFFAOYSA-N
Molecular Weight 128.215 g/mol
SMILES CC(CCCCCC)=O
SPLASH splash10-052f-9000000000-063748c7f1ce2a8991e3
Source of Spectrum O-19-521-8
Synonyms 2-Oxooctane Hexyl methyl ketone Methyl hexyl ketone Methyl n-hexyl ketone N-C6H13COCH3 n-Hexyl methyl ketone Octan-2-one AI3-05617 BRN 0635843 EINECS 203-837-1 FEMA NO. 2802 HSDB 5545 NSC 3712
Wiley ID 1131564