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3-(1-Methyl-2-propenyl)-2,4-pentanedione
SpectraBase Compound ID EzDbVpxf9mV
InChI InChI=1S/C9H14O2/c1-5-6(2)9(7(3)10)8(4)11/h5-6,9H,1H2,2-4H3
InChIKey KHWGTUYFYLZNOT-UHFFFAOYSA-N
Mol Weight 154.21 g/mol
Molecular Formula C9H14O2
Exact Mass 154.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9HnssJCJ3V
Name 3-(1-Methyl-2-propenyl)-2,4-pentanedione
Alternate Name(s) 2,4-Pentanedione, 3-(1-methyl-2-propenyl)- 5-Hexen-2-one, 3-acetyl-4-methyl- 3-(1-Methylallyl)pentane-2,4-dione 3-But-3-en-2-ylpentane-2,4-dione
CAS Registry Number 29149-83-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H14O2
InChI InChI=1S/C9H14O2/c1-5-6(2)9(7(3)10)8(4)11/h5-6,9H,1H2,2-4H3
InChIKey KHWGTUYFYLZNOT-UHFFFAOYSA-N
Molecular Weight 154.209 g/mol
SMILES CC(C=C)C(C(=O)C)C(=O)C
SPLASH splash10-0006-9000000000-bbe63c6fee3db63e2955
Wiley ID 1495644