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WILFORIC-ACID-A
SpectraBase Compound ID PcWhXtQGms
InChI InChI=1S/C29H42O4/c1-17-18-7-8-21-27(4,19(18)15-20(30)23(17)31)12-14-29(6)22-16-26(3,24(32)33)10-9-25(22,2)11-13-28(21,29)5/h15,21-22,30-31H,7-14,16H2,1-6H3,(H,32,33)/t21-,22+,25+,26+,27-,28+,29-/m0/s1
InChIKey NBMIXMLIGPLJPK-KHYSSQCESA-N
Mol Weight 454.7 g/mol
Molecular Formula C29H42O4
Exact Mass 454.30831 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9kDBZcMrtnv
Name WILFORIC-ACID-A
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H42O4
InChI InChI=1S/C29H42O4/c1-17-18-7-8-21-27(4,19(18)15-20(30)23(17)31)12-14-29(6)22-16-26(3,24(32)33)10-9-25(22,2)11-13-28(21,29)5/h15,21-22,30-31H,7-14,16H2,1-6H3,(H,32,33)/t21-,22+,25+,26+,27-,28+,29-/m0/s1
InChIKey NBMIXMLIGPLJPK-KHYSSQCESA-N
Literature Reference Author H.DUAN,K.KAWAZOE,M.BANDO,M.KIDO,Y.TAKAISHI
Literature Reference Citation PHYTOCHEM.,46,535(1997)
Literature Reference DOI 10.1016/s0031-9422(97)00288-4
Molecular Weight 454.650 g/mol
Sample ID 52624
Solvent C5D5N