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2,6-Heptanedione, 3-methylene-
SpectraBase Compound ID FTGUQNaGkCj
InChI InChI=1S/C8H12O2/c1-6(8(3)10)4-5-7(2)9/h1,4-5H2,2-3H3
InChIKey FFPAMXZGKPTNDP-UHFFFAOYSA-N
Mol Weight 140.18 g/mol
Molecular Formula C8H12O2
Exact Mass 140.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3fW2asDvxgQ
Name 3-methyleneheptane-2,6-dione
Comments Removed - expert review: contamination (air); A corrected record has been addded having SpectrumID: 1821033
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H12O2
InChI InChI=1S/C8H12O2/c1-6(8(3)10)4-5-7(2)9/h1,4-5H2,2-3H3
InChIKey FFPAMXZGKPTNDP-UHFFFAOYSA-N
Molecular Weight 140.182 g/mol
SMILES CC(=O)C(CCC(=O)C)=C
SPLASH splash10-016u-9000000000-67a0ee85d8423bfab016
Synonyms 3-methylideneheptane-2,6-dione
Wiley ID 1472210