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Tenellic acid C
SpectraBase Compound ID 1bc0mBtGkEg
InChI InChI=1S/C23H26O8/c1-12(2)8-19(30-14(4)25)16-6-7-18(20(23(27)28)22(16)29-5)31-21-15(11-24)9-13(3)10-17(21)26/h6-7,9-12,19,26H,8H2,1-5H3,(H,27,28)
InChIKey IGGGJHYOBPGVLF-UHFFFAOYSA-N
Mol Weight 430.45 g/mol
Molecular Formula C23H26O8
Exact Mass 430.162768 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DJhUKPZ1QRr
Name Tenellic acid C
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H26O8
InChI InChI=1S/C23H26O8/c1-12(2)8-19(30-14(4)25)16-6-7-18(20(23(27)28)22(16)29-5)31-21-15(11-24)9-13(3)10-17(21)26/h6-7,9-12,19,26H,8H2,1-5H3,(H,27,28)
InChIKey IGGGJHYOBPGVLF-UHFFFAOYSA-N
Molecular Weight 430.453 g/mol
SMILES Oc1cc(cc(c1Oc1ccc(c(c1C(=O)O)OC)C(OC(=O)C)CC(C)C)C=O)C
SPLASH splash10-00y0-0569000000-90e108526f0889da3c78
Source of Spectrum G4-62-583-3
Synonyms 3-(1-acetoxy-3-methyl-butyl)-6-(2-formyl-6-hydroxy-4-methyl-phenoxy)-2-methoxy-benzoic acid 3-(1-acetyloxy-3-methyl-butyl)-6-(2-methanoyl-4-methyl-6-oxidanyl-phenoxy)-2-methoxy-benzoic acid
Wiley ID 1607819