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3-Heptanone, 2,6-dimethyl-
SpectraBase Compound ID 3oGxuCdNx1P
InChI InChI=1S/C9H18O/c1-7(2)5-6-9(10)8(3)4/h7-8H,5-6H2,1-4H3
InChIKey HFNWDYQEGABWQS-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 Gi1DgvQL4fY
Name 3-Heptanone, 2,6-dimethyl-
Alternate Name(s) 2,6-Dimethyl-3-heptanone 2,6-Dimethylheptan-3-one EINECS 243-149-9
CAS Registry Number 19549-83-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H18O
InChI InChI=1S/C9H18O/c1-7(2)5-6-9(10)8(3)4/h7-8H,5-6H2,1-4H3
InChIKey HFNWDYQEGABWQS-UHFFFAOYSA-N
Molecular Weight 142.242 g/mol
SMILES CC(CCC(=O)C(C)C)C
SPLASH splash10-0006-9000000000-d676bec4e1d4f4c17cad
Source of Spectrum JZ-1992-1135-0
Wiley ID 1141489