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2,6-Heptanedione, 3-methyl-3-(1-methylethyl)-
SpectraBase Compound ID 5QIFcFLqXEB
InChI InChI=1S/C11H20O2/c1-8(2)11(5,10(4)13)7-6-9(3)12/h8H,6-7H2,1-5H3
InChIKey MIRROKWMSAODOR-UHFFFAOYSA-N
Mol Weight 184.28 g/mol
Molecular Formula C11H20O2
Exact Mass 184.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AP7jdHLkQPW
Name 2,6-Heptanedione, 3-methyl-3-(1-methylethyl)-
CAS Registry Number 63922-59-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H20O2
InChI InChI=1S/C11H20O2/c1-8(2)11(5,10(4)13)7-6-9(3)12/h8H,6-7H2,1-5H3
InChIKey MIRROKWMSAODOR-UHFFFAOYSA-N
Molecular Weight 184.279 g/mol
SMILES CC(C(C(C)=O)(C)CCC(=O)C)C
SPLASH splash10-006x-9300000000-3cedfb75d5b6b37c76b1
Synonyms 3-Isopropyl-3-methyl-2,6-heptanedione 3-isopropyl-3-methyl-heptane-2,6-dione 3-Methyl-3-propan-2-yl-heptane-2,6-dione
Wiley ID 1487431