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3-methylvaleraldehyde
SpectraBase Compound ID EJJf6qc1BHK
InChI InChI=1S/C6H12O/c1-3-6(2)4-5-7/h5-6H,3-4H2,1-2H3
InChIKey YJWJGLQYQJGEEP-UHFFFAOYSA-N
Mol Weight 100.16 g/mol
Molecular Formula C6H12O
Exact Mass 100.088815 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DAt3nAa0GIt
Name
CAS Registry Number 15877-57-3
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C6H12O
InChI InChI=1S/C6H12O/c1-3-6(2)4-5-7/h5-6H,3-4H2,1-2H3
InChIKey YJWJGLQYQJGEEP-UHFFFAOYSA-N
Instrument Name Special
Literature Reference G.E. Hawkes, K. Herwig, J.D. Roberts, J. Org. Chem. 39, 1017 (1974).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3