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POILWHVDKZOXJZ-ARJAWSKDSA-N

View entire compound with spectra: 99 NMR

POILWHVDKZOXJZ-ARJAWSKDSA-N
SpectraBase Compound ID 3Bg28C4MPXA
InChI InChI=1S/C5H8O2/c1-4(6)3-5(2)7/h3,6H,1-2H3/b4-3-
InChIKey POILWHVDKZOXJZ-ARJAWSKDSA-N
Mol Weight 100.12 g/mol
Molecular Formula C5H8O2
Exact Mass 100.052429 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K0vB7gLYNst
Name ACETYLACETONE,ENOL-ISOMER
CAS Registry Number 1522-20-9
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C5H8O2
InChI InChI=1S/C5H8O2/c1-4(6)3-5(2)7/h3,6H,1-2H3/b4-3-
InChIKey POILWHVDKZOXJZ-ARJAWSKDSA-N
Literature Reference Author S.SELTZER
Literature Reference Citation J.ORG.CHEM.,46,2643(1981)
Literature Reference DOI 10.1021/jo00326a007
Molecular Weight 100.117 g/mol
Solvent CDCl3
Source File Reference UWCS8933