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3-Octanone
SpectraBase Compound ID 10QFzfVJd3P
InChI InChI=1S/C8H16O/c1-3-5-6-7-8(9)4-2/h3-7H2,1-2H3
InChIKey RHLVCLIPMVJYKS-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 8TrW0n7NiKc
Name 3-Octanone
Alternate Name(s) 3-Oxooctane Amyl ethyl ketone EAK Ethyl n-amyl ketone Ethyl n-pentyl ketone Ethyl pentyl ketone n-Octanone-3 Octan-3-one Ethyl amyl ketone AI3-36116 BRN 1700021 EINECS 203-423-0 FEMA NO. 2803 HSDB 5371 NSC 60161 UN2271
CAS Registry Number 106-68-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H16O
InChI InChI=1S/C8H16O/c1-3-5-6-7-8(9)4-2/h3-7H2,1-2H3
InChIKey RHLVCLIPMVJYKS-UHFFFAOYSA-N
Molecular Weight 128.215 g/mol
SMILES CCCCCC(=O)CC
SPLASH splash10-0596-9000000000-b8eb365cf86711861574
Source of Spectrum UT-1990-31-0
Wiley ID 1131567