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2-METHYL-3-OXO-PENTANAL;SODIUM-SALT

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2-METHYL-3-OXO-PENTANAL;SODIUM-SALT
SpectraBase Compound ID 7DyHeywqYbD
InChI InChI=1S/C6H10O2.Na/c1-3-6(8)5(2)4-7;/h4,7H,3H2,1-2H3;/q;+1/p-1/b5-4+;
InChIKey JWDDEPBHMQXUGS-FXRZFVDSSA-M
Mol Weight 136.13 g/mol
Molecular Formula C6H9NaO2
Exact Mass 136.050024 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4Kk2sMs2Jz0
Name 2-METHYL-3-OXO-PENTANAL;SODIUM-SALT
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C6H9NaO2
InChI InChI=1S/C6H10O2.Na/c1-3-6(8)5(2)4-7;/h4,7H,3H2,1-2H3;/q;+1/p-1/b5-4+;
InChIKey JWDDEPBHMQXUGS-FXRZFVDSSA-M
Literature Reference Author J.B.PAINE-III
Literature Reference Citation J.HETCYCL.CHEM.,24,351(1987)
Literature Reference DOI 10.1002/jhet.5570240211
Molecular Weight 136.126 g/mol
Solvent D2O
Source File Reference UWED7493