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(3S)-3-METHYLHEXANAL

View entire compound with spectra: 1 NMR

(3S)-3-METHYLHEXANAL
SpectraBase Compound ID L3BI0z4YO04
InChI InChI=1S/C7H14O/c1-3-4-7(2)5-6-8/h6-7H,3-5H2,1-2H3/t7-/m0/s1
InChIKey ZSJUABCTGCNBPF-ZETCQYMHSA-N
Mol Weight 114.19 g/mol
Molecular Formula C7H14O
Exact Mass 114.104465 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K2aZtZSgpPZ
Name (3S)-3-METHYLHEXANAL
Compound Number 13
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H14O
InChI InChI=1S/C7H14O/c1-3-4-7(2)5-6-8/h6-7H,3-5H2,1-2H3/t7-/m0/s1
InChIKey ZSJUABCTGCNBPF-ZETCQYMHSA-N
Literature Reference Author D.R.WILLIAMS,A.L.NOLD,R.J.MULLINS
Literature Reference Citation J.ORG.CHEM.,69,5374(2004)
Literature Reference DOI 10.1021/jo049567e
Molecular Weight 114.188 g/mol
Solvent Unknown
Source File Reference UWVN22111