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(2,3-(C-13))-6,6-DIMETHOXY-5-METHYLHEXA-2,4-DIEN-1-AL
SpectraBase Compound ID 7G48O1LEbMr
InChI InChI=1S/C9H14O3/c1-8(6-4-5-7-10)9(11-2)12-3/h4-7,9H,1-3H3/b5-4+,8-6+/i4+1,5+1
InChIKey GASLRIQONZEFBC-QTCZRGDESA-N
Mol Weight 172.19 g/mol
Molecular Formula C713C2H14O3
Exact Mass 172.101004 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7XROU7Rldmv
Name (2,3-(C-13))-6,6-DIMETHOXY-5-METHYLHEXA-2,4-DIEN-1-AL
Compound Number 5B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C713C2H14O3
InChI InChI=1S/C9H14O3/c1-8(6-4-5-7-10)9(11-2)12-3/h4-7,9H,1-3H3/b5-4+,8-6+/i4+1,5+1
InChIKey GASLRIQONZEFBC-QTCZRGDESA-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 172.193 g/mol
Solvent CDCl3
Source File Reference UWCH109