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2,4,6-TRIHYDROXY-5-ISOBUTYLISOPHTHALALDEHYDE
SpectraBase Compound ID 8g9gTfgiDUx
InChI InChI=1S/C13H16O5/c1-7(2)3-4-8-11(16)9(5-14)13(18)10(6-15)12(8)17/h5-7,16-18H,3-4H2,1-2H3
InChIKey GHBYTBMILCMVGY-UHFFFAOYSA-N
Mol Weight 252.27 g/mol
Molecular Formula C13H16O5
Exact Mass 252.099774 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5yhOhd77mY4
Name 2,4,6-TRIHYDROXY-5-ISOBUTYLISOPHTHALALDEHYDE
Compound Number 37
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H16O5
InChI InChI=1S/C13H16O5/c1-7(2)3-4-8-11(16)9(5-14)13(18)10(6-15)12(8)17/h5-7,16-18H,3-4H2,1-2H3
InChIKey GHBYTBMILCMVGY-UHFFFAOYSA-N
Literature Reference Author T.TANAKA,H.MIKAMIYAMA,K.MAEDA,C.IWATA
Literature Reference Citation J.ORG.CHEM.,63,9782(1998)
Literature Reference DOI 10.1021/jo981413+
Molecular Weight 252.267 g/mol
Solvent CD3OD
Source File Reference UWSI26764