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2-Pentanone
SpectraBase Compound ID 87Ud5cE2m4v
InChI InChI=1S/C5H10O/c1-3-4-5(2)6/h3-4H2,1-2H3
InChIKey XNLICIUVMPYHGG-UHFFFAOYSA-N
Mol Weight 86.13 g/mol
Molecular Formula C5H10O
Exact Mass 86.073165 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FxklFUYb3if
Name Propyl methyl ketone
Source of Sample SAFC Cat.no. W284203
CAS Registry Number 107-87-9
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 86.073164941 u
Formula C5H10O
InChI InChI=1S/C5H10O/c1-3-4-5(2)6/h3-4H2,1-2H3
InChIKey XNLICIUVMPYHGG-UHFFFAOYSA-N
Molecular Weight 86.134 g/mol
Number of Peaks 35
RI1 682
RI3 382
RI4 365
SMILES CC(CCC)=O
SPLASH splash10-0006-9000000000-517b14652b1547f1b3d4
Sample Comments RI1: measured on SLB-5ms (Hydro) RI2: measured on SLB-5ms (FAMEs) RI3: measured on Supelcowax-10 (FAMEs) RI4: measured on Supelcowax-10 (FAEEs) RI5: measured on Equity-1 (Hydro)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms 2-Pentanone
Wiley ID LM_FFNSC3_505