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6-Methylheptan-2,4-dione
SpectraBase Compound ID 8fUCqqX55pQ
InChI InChI=1S/C8H14O2/c1-6(2)4-8(10)5-7(3)9/h6H,4-5H2,1-3H3
InChIKey IGMOYJSFRIASIE-UHFFFAOYSA-N
Mol Weight 142.2 g/mol
Molecular Formula C8H14O2
Exact Mass 142.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DWiccKen6Rp
Name 2,4-Heptanedione, 6-methyl-
Alternate Name(s) 6-Methyl-2,4-heptanedione 6-Methylheptane-2,4-dione Isovalerylacetone AI3-11696 EINECS 221-093-6 NSC 94
CAS Registry Number 3002-23-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H14O2
InChI InChI=1S/C8H14O2/c1-6(2)4-8(10)5-7(3)9/h6H,4-5H2,1-3H3
InChIKey IGMOYJSFRIASIE-UHFFFAOYSA-N
Molecular Weight 142.198 g/mol
SMILES CC(CC(=O)CC(C)=O)C
SPLASH splash10-000l-9100000000-c097dbf1ee0eabcfaa78
Source of Spectrum AD-0-3384-0
Wiley ID 8243