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2,6-Dimethyl-4-heptanone
SpectraBase Compound ID 5jn2OmKSw7W
InChI InChI=1S/C9H18O/c1-7(2)5-9(10)6-8(3)4/h7-8H,5-6H2,1-4H3
InChIKey PTTPXKJBFFKCEK-UHFFFAOYSA-N
Mol Weight 142.24 g/mol
Molecular Formula C9H18O
Exact Mass 142.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7CPnt9OU3CG
Name Isobutyl ketone
Source of Sample SAFC Cat. #W353701
CAS Registry Number 108-83-8
Classification Solvents
Copyright Copyright © 2016-2024  John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H18O
InChI InChI=1S/C9H18O/c1-7(2)5-9(10)6-8(3)4/h7-8H,5-6H2,1-4H3
InChIKey PTTPXKJBFFKCEK-UHFFFAOYSA-N
Number of Peaks 50
RI1 970
RI2 956
SMILES CC(CC(=O)CC(C)C)C
SPLASH splash10-0a4r-9000000000-fccef733e197c5f8d477
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms 4-Heptanone, 2,6-dimethyl-
Wiley ID LM_PEST_1221