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METHYL_3-FORMYLHEPTANOATE

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METHYL_3-FORMYLHEPTANOATE
SpectraBase Compound ID JDNp1x6q0MG
InChI InChI=1S/C9H16O3/c1-3-4-5-8(7-10)6-9(11)12-2/h7-8H,3-6H2,1-2H3
InChIKey YZQLQOXYIJJCSI-UHFFFAOYSA-N
Mol Weight 172.22 g/mol
Molecular Formula C9H16O3
Exact Mass 172.109944 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KS1JrbabMcG
Name METHYL_3-FORMYLHEPTANOATE
Compound Number 4C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H16O3
InChI InChI=1S/C9H16O3/c1-3-4-5-8(7-10)6-9(11)12-2/h7-8H,3-6H2,1-2H3
InChIKey YZQLQOXYIJJCSI-UHFFFAOYSA-N
Literature Reference Author D.M.HODGSON,C.D.BRAY,N.D.KINDON
Literature Reference Citation J.AM.CHEM.SOC.,126,6870(2004)
Literature Reference DOI 10.1021/ja031770o
Molecular Weight 172.224 g/mol
Solvent CDCl3
Source File Reference UWMZ24496