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METHYL-[1,2-(13)-C-(2)]-NONANOATE

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METHYL-[1,2-(13)-C-(2)]-NONANOATE
SpectraBase Compound ID FwuaWCXGN1r
InChI InChI=1S/C10H20O2/c1-3-4-5-6-7-8-9-10(11)12-2/h3-9H2,1-2H3/i9+1,10+1
InChIKey IJXHLVMUNBOGRR-OJJJIBSVSA-N
Mol Weight 174.25 g/mol
Molecular Formula C813C2H20O2
Exact Mass 174.15304 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GOdXwUZVIDi
Name METHYL-[1,2-(13)-C-(2)]-NONANOATE
Compound Number 28
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C813C2H20O2
InChI InChI=1S/C10H20O2/c1-3-4-5-6-7-8-9-10(11)12-2/h3-9H2,1-2H3/i9+1,10+1
InChIKey IJXHLVMUNBOGRR-OJJJIBSVSA-N
Literature Reference Author Y.SEKIYAMA,Y.FUJIMOTO,K.HASUMI,A.ENDO
Literature Reference Citation J.ORG.CHEM.,66,5649(2001)
Literature Reference DOI 10.1021/jo015614g
Molecular Weight 174.252 g/mol
Solvent CDCl3
Source File Reference UWVN24040