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3-acetyl-6-methyl-2H-pyran-2,4(3H)-dione

View entire compound with spectra: 27 NMR, and 2 MS (GC)

3-acetyl-6-methyl-2H-pyran-2,4(3H)-dione
SpectraBase Compound ID B81TERUD4r3
InChI InChI=1S/C8H8O4/c1-4-3-6(10)7(5(2)9)8(11)12-4/h3,10H,1-2H3
InChIKey PKLPQOJFHFGVBS-UHFFFAOYSA-N
Mol Weight 168.15 g/mol
Molecular Formula C8H8O4
Exact Mass 168.042259 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A5xBvIFIt1n
Name PKLPQOJFHFGVBS-UHFFFAOYSA-N
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H8O4
InChI InChI=1S/C8H8O4/c1-4-3-6(10)7(5(2)9)8(11)12-4/h3,10H,1-2H3
InChIKey PKLPQOJFHFGVBS-UHFFFAOYSA-N
Literature Reference Author T.D.CYR,G.A.POULTON
Literature Reference Citation CAN.J.CHEM.,60,133(1982)
Literature Reference DOI 10.1139/v82-023
Molecular Weight 168.149 g/mol
Solvent CDCl3
Source File Reference UWED3991