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CIMICIFUGIC-ACID-C

View entire compound with spectra: 1 NMR

CIMICIFUGIC-ACID-C
SpectraBase Compound ID 8jsoMLdQj3L
InChI InChI=1S/C20H18O10/c21-13-5-1-11(2-6-13)4-8-16(24)30-17(18(25)26)20(29,19(27)28)10-12-3-7-14(22)15(23)9-12/h1-9,17,21-23,29H,10H2,(H,25,26)(H,27,28)/b8-4+/t17-,20+/m1/s1
InChIKey NIDSBIYSGNHVDL-VJCVNLAASA-N
Mol Weight 418.35 g/mol
Molecular Formula C20H18O10
Exact Mass 418.089997 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H1On0abtQn6
Name CIMICIFUGIC-ACID-C
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H18O10
InChI InChI=1S/C20H18O10/c21-13-5-1-11(2-6-13)4-8-16(24)30-17(18(25)26)20(29,19(27)28)10-12-3-7-14(22)15(23)9-12/h1-9,17,21-23,29H,10H2,(H,25,26)(H,27,28)/b8-4+/t17-,20+/m1/s1
InChIKey NIDSBIYSGNHVDL-VJCVNLAASA-N
Literature Reference Author M.TAKAHIRA,A.KUSANO,M.SHIBANO,G.KUSANO,N.SAKURAI,M.NAGAI,T.M IYASE
Literature Reference Citation CHEM.PHARM.BULL.,46,362(1998)
Literature Reference DOI 10.1248/cpb.46.362
Molecular Weight 418.357 g/mol
Solvent CD3OD
Source File Reference UWMS6246