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6-O-PARA-HYDROXYBENZOYLAJUGOL
SpectraBase Compound ID 9LNuiMQL6Sc
InChI InChI=1S/C22H28O11/c1-22(29)8-13(31-19(28)10-2-4-11(24)5-3-10)12-6-7-30-20(15(12)22)33-21-18(27)17(26)16(25)14(9-23)32-21/h2-7,12-18,20-21,23-27,29H,8-9H2,1H3/t12-,13+,14-,15+,16-,17+,18-,20-,21+,22-/m0/s1
InChIKey MYLAQALEHHPXFU-ATKAWZCBSA-N
Mol Weight 468.46 g/mol
Molecular Formula C22H28O11
Exact Mass 468.163162 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 19hwMLN3ViY
Name 6-O-PARA-HYDROXYBENZOYLAJUGOL
Compound Number 37
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H28O11
InChI InChI=1S/C22H28O11/c1-22(29)8-13(31-19(28)10-2-4-11(24)5-3-10)12-6-7-30-20(15(12)22)33-21-18(27)17(26)16(25)14(9-23)32-21/h2-7,12-18,20-21,23-27,29H,8-9H2,1H3/t12-,13+,14-,15+,16-,17+,18-,20-,21+,22-/m0/s1
InChIKey MYLAQALEHHPXFU-ATKAWZCBSA-N
Literature Reference Author C.A.BOROS,F.R.STERMITZ
Literature Reference Citation J.NAT.PROD.,53,1055(1990)
Literature Reference DOI 10.1021/np50071a001
Molecular Weight 468.458 g/mol
Solvent CD3OD
Source File Reference UWMZ16034