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1-(ACETYLOXY)-4-METHYL-2-PENTANONE

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1-(ACETYLOXY)-4-METHYL-2-PENTANONE
SpectraBase Compound ID 5iWVgN0Hngx
InChI InChI=1S/C8H14O3/c1-6(2)4-8(10)5-11-7(3)9/h6H,4-5H2,1-3H3
InChIKey UDABZELGNFSHNV-UHFFFAOYSA-N
Mol Weight 158.2 g/mol
Molecular Formula C8H14O3
Exact Mass 158.094294 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7sQM5seWTgB
Name 1-(ACETYLOXY)-4-METHYL-2-PENTANONE
CAS Registry Number 141665-39-6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H14O3
InChI InChI=1S/C8H14O3/c1-6(2)4-8(10)5-11-7(3)9/h6H,4-5H2,1-3H3
InChIKey UDABZELGNFSHNV-UHFFFAOYSA-N
Literature Reference Author M.SINGH,R.W.MURRAY
Literature Reference Citation J.ORG.CHEM.,57,4263(1992)
Literature Reference DOI 10.1021/jo00041a036
Molecular Weight 158.197 g/mol
Solvent CDCl3
Source File Reference UWCS1079