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5-Methyl-2-hexanone
SpectraBase Compound ID 5ZC8IErY2vt
InChI InChI=1S/C7H14O/c1-6(2)4-5-7(3)8/h6H,4-5H2,1-3H3
InChIKey FFWSICBKRCICMR-UHFFFAOYSA-N
Mol Weight 114.19 g/mol
Molecular Formula C7H14O
Exact Mass 114.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gni512XGwMF
Name 2-Hexanone, 5-methyl-
CAS Registry Number 110-12-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H14O
InChI InChI=1S/C7H14O/c1-6(2)4-5-7(3)8/h6H,4-5H2,1-3H3
InChIKey FFWSICBKRCICMR-UHFFFAOYSA-N
Molecular Weight 114.188 g/mol
SMILES CC(=O)CCC(C)C
SPLASH splash10-0006-9000000000-73f1947b944cce9e3139
Source of Spectrum AA-0-406-5
Synonyms (CH3)2CHCH2CH2COCH3 2-Methyl-5-hexanone 5-Methyl-2-hexanone 5-Methylhexan-2-one Isoamyl methyl ketone Isopentyl methyl ketone Ketone, methyl isoamyl Methyl isoamyl ketone Methyl isopentyl ketone MIAK BRN 0506163 EINECS 203-737-8 HSDB 2885 UN2302
Wiley ID 1124662