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Dimethyl penta-o-methyldehydrodigallate

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Dimethyl penta-o-methyldehydrodigallate
SpectraBase Compound ID 2sJkhNGVaZ4
InChI InChI=1S/C21H24O10/c1-24-13-8-11(20(22)29-6)9-15(17(13)26-3)31-16-12(21(23)30-7)10-14(25-2)18(27-4)19(16)28-5/h8-10H,1-7H3
InChIKey ZPESEMZCGKYTGM-UHFFFAOYSA-N
Mol Weight 436.41 g/mol
Molecular Formula C21H24O10
Exact Mass 436.136947 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K4ZTp6vb9Yi
Name Dimethyl penta-o-methyldehydrodigallate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 436.136946963 u
Formula C21H24O10
InChI InChI=1S/C21H24O10/c1-24-13-8-11(20(22)29-6)9-15(17(13)26-3)31-16-12(21(23)30-7)10-14(25-2)18(27-4)19(16)28-5/h8-10H,1-7H3
InChIKey ZPESEMZCGKYTGM-UHFFFAOYSA-N
Molecular Weight 436.413 g/mol
SMILES C1(=C(C(OC)=C(C(=C1)OC)OC)OC1=C(C(OC)=CC(=C1)C(=O)OC)OC)C(=O)OC