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(2,3-(C-13))-6,6-DIMETHOXY-5-METHYLHEXA-2,4-DIENE-1-NITRILE
SpectraBase Compound ID CjTBJ1J2kJx
InChI InChI=1S/C9H13NO2/c1-8(6-4-5-7-10)9(11-2)12-3/h4-6,9H,1-3H3/b5-4+,8-6-/i4+1,5+1
InChIKey DDINOLCMHDORBI-VAZMYBBQSA-N
Mol Weight 169.19 g/mol
Molecular Formula C713C2H13NO2
Exact Mass 169.101338 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Eurd5Mils2M
Name (2,3-(C-13))-6,6-DIMETHOXY-5-METHYLHEXA-2,4-DIENE-1-NITRILE
Compound Number 21B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C713C2H13NO2
InChI InChI=1S/C9H13NO2/c1-8(6-4-5-7-10)9(11-2)12-3/h4-6,9H,1-3H3/b5-4+,8-6-/i4+1,5+1
InChIKey DDINOLCMHDORBI-VAZMYBBQSA-N
Literature Reference Author F.J.H.M.JANSEN,M.KWESTRO,D.SCHMITT,J.LUGTENBURG
Literature Reference Citation REC.TR.CH.P.-B.,113,552(1994)
Literature Reference DOI 10.1002/recl.19941131205
Molecular Weight 169.192 g/mol
Solvent CDCl3
Source File Reference UWCH106