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METHYL-(E,E)-7-NITRO-2,6-OCTADIENOATE
SpectraBase Compound ID keR3fUThXC
InChI InChI=1S/C9H13NO4/c1-8(10(12)13)6-4-3-5-7-9(11)14-2/h5-7H,3-4H2,1-2H3/b7-5+,8-6+
InChIKey UUDDOJUFDIJAEO-KQQUZDAGSA-N
Mol Weight 199.21 g/mol
Molecular Formula C9H13NO4
Exact Mass 199.084458 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BAkyWX2v2xu
Name METHYL-(E,E)-7-NITRO-2,6-OCTADIENOATE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H13NO4
InChI InChI=1S/C9H13NO4/c1-8(10(12)13)6-4-3-5-7-9(11)14-2/h5-7H,3-4H2,1-2H3/b7-5+,8-6+
InChIKey UUDDOJUFDIJAEO-KQQUZDAGSA-N
Literature Reference Author S.E.DENMARK,C.B.W.SENANAYAKE
Literature Reference Citation J.ORG.CHEM.,58,1853(1993)
Literature Reference DOI 10.1021/jo00059a043
Molecular Weight 199.207 g/mol
Solvent CDCl3
Source File Reference UWCS22411