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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 LLRA74mBEa
Name 2,3-pentanedione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 100.052429496 u
Formula C5H8O2
GC Oven Program Oven temp 250oC
InChI InChI=1S/C5H8O2/c1-3-5(7)4(2)6/h3H2,1-2H3
InChIKey TZMFJUDUGYTVRY-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/jhrc.1240150206
Molecular Weight 100.117 g/mol
Quality 285
SMILES CC(C(CC)=O)=O
SPLASH splash10-0006-9000000000-e2639288a2c5459a2081
Source of Spectrum HRC-15-86-2 (DOI: 10.1002/jhrc.1240150206)
Wiley ID 1910792