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4'-(S)-[ALPHA-METHOXY-ALPHA-(TRIFLUOROMETHYL)-PHENYLACETYL]-STRICTIFOLIONE
SpectraBase Compound ID 7v2NotrZtIZ
InChI InChI=1S/C29H31F3O6/c1-36-28(29(30,31)32,22-12-6-3-7-13-22)27(35)38-25(16-8-14-24-15-9-17-26(34)37-24)20-23(33)19-18-21-10-4-2-5-11-21/h2-14,17,23-25,33H,15-16,18-20H2,1H3/b14-8+/t23-,24+,25+,28-/m0/s1
InChIKey VRIHJKYZCTZDDH-NVMLABKZSA-N
Mol Weight 532.56 g/mol
Molecular Formula C29H31F3O6
Exact Mass 532.207273 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6whz4Zpax0W
Name 4'-(S)-[ALPHA-METHOXY-ALPHA-(TRIFLUOROMETHYL)-PHENYLACETYL]-STRICTIFOLIONE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H31F3O6
InChI InChI=1S/C29H31F3O6/c1-36-28(29(30,31)32,22-12-6-3-7-13-22)27(35)38-25(16-8-14-24-15-9-17-26(34)37-24)20-23(33)19-18-21-10-4-2-5-11-21/h2-14,17,23-25,33H,15-16,18-20H2,1H3/b14-8+/t23-,24+,25+,28-/m0/s1
InChIKey VRIHJKYZCTZDDH-NVMLABKZSA-N
Literature Reference Author L.D.JULIAWATY,M.KITAJIMA,H.TAKAYAMA,S.A.ACHMAD,N.AIMI
Literature Reference Citation PHYTOCHEM.,54,989(2000)
Literature Reference DOI 10.1016/S0031-9422(00)00077-7
Molecular Weight 532.557 g/mol
Solvent CDCl3
Source File Reference UWLU1560