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2,3-Pentanedione
SpectraBase Compound ID JhbK65ZezJY
InChI InChI=1S/C5H8O2/c1-3-5(7)4(2)6/h3H2,1-2H3
InChIKey TZMFJUDUGYTVRY-UHFFFAOYSA-N
Mol Weight 100.12 g/mol
Molecular Formula C5H8O2
Exact Mass 100.052429 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4cUQbWiBijR
Name 2,3-Pentanedione
Alternate Name(s) 2,3-Pentadione Acetylpropionyl CH3C(O)C(O)C2H5 Pentan-2,3-dione Pentane-2,3-dione BRN 1699638 CCRIS 2946 EINECS 209-984-8 FEMA NO. 2841 NSC 7613
CAS Registry Number 600-14-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H8O2
InChI InChI=1S/C5H8O2/c1-3-5(7)4(2)6/h3H2,1-2H3
InChIKey TZMFJUDUGYTVRY-UHFFFAOYSA-N
Molecular Weight 100.117 g/mol
SMILES CC(C(=O)CC)=O
SPLASH splash10-002f-9000000000-e512d607959c3530a1d2
Source of Spectrum AA-0-248-4
Wiley ID 1682