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PREUSSOMERIN_C
SpectraBase Compound ID Lq90iCGQt8H
InChI InChI=1S/C21H16O8/c1-25-13-7-10(23)8-3-2-4-11-15(8)20(13)27-12-6-5-9(22)14-16(12)21(28-11,29-20)19-18(26-19)17(14)24/h2-6,13,17-19,22,24H,7H2,1H3/t13-,17-,18-,19-,20-,21+/m1/s1
InChIKey DIBXCWWZBPEJSW-MFGAOICXSA-N
Mol Weight 396.35 g/mol
Molecular Formula C21H16O8
Exact Mass 396.084517 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7djVedv4wkn
Name PREUSSOMERIN_C
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H16O8
InChI InChI=1S/C21H16O8/c1-25-13-7-10(23)8-3-2-4-11-15(8)20(13)27-12-6-5-9(22)14-16(12)21(28-11,29-20)19-18(26-19)17(14)24/h2-6,13,17-19,22,24H,7H2,1H3/t13-,17-,18-,19-,20-,21+/m1/s1
InChIKey DIBXCWWZBPEJSW-MFGAOICXSA-N
Literature Reference Author J.Y.DONG,H.C.SONG,J.H.LI,Y.S.TANG,R.SUN,L.WANG,Y.P.ZHOU,L.M. WANG,K.Z.SHEN,C.R.WA
Literature Reference Citation J.NAT.PROD.,71,952(2008)
Literature Reference DOI 10.1021/np800034g
Molecular Weight 396.353 g/mol
Sample ID 28377
Solvent ACETONE-D6