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2-METHYL-3-OXO-BUTANAL;SODIUM-SALT
SpectraBase Compound ID 8ufOxL3LL3B
InChI InChI=1S/C5H8O2.Na/c1-4(3-6)5(2)7;/h3,6H,1-2H3;/q;+1/p-1/b4-3+;
InChIKey VZUJKSCAQOORQX-BJILWQEISA-M
Mol Weight 122.1 g/mol
Molecular Formula C5H7NaO2
Exact Mass 122.034374 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5GxFFDjY3EE
Name 2-METHYL-3-OXO-BUTANAL;SODIUM-SALT
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C5H7NaO2
InChI InChI=1S/C5H8O2.Na/c1-4(3-6)5(2)7;/h3,6H,1-2H3;/q;+1/p-1/b4-3+;
InChIKey VZUJKSCAQOORQX-BJILWQEISA-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 122.099 g/mol
Solvent D2O
Source File Reference UWED7488