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METHYL-17-((R)-METHOXYTRIFLUOROMETHYLPHENYLACETOXY)-DOCOSANOATE
SpectraBase Compound ID 1HGOlMyvUHN
InChI InChI=1S/C33H53F3O5/c1-4-5-18-25-29(41-31(38)32(40-3,33(34,35)36)28-23-19-17-20-24-28)26-21-15-13-11-9-7-6-8-10-12-14-16-22-27-30(37)39-2/h17,19-20,23-24,29H,4-16,18,21-22,25-27H2,1-3H3/t29?,32-/m1/s1
InChIKey AMZCABQCKUUOFO-CUPMVOCTSA-N
Mol Weight 586.8 g/mol
Molecular Formula C33H53F3O5
Exact Mass 586.384509 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7JcC6azlEDU
Name METHYL-17-((R)-METHOXYTRIFLUOROMETHYLPHENYLACETOXY)-DOCOSANOATE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H53F3O5
InChI InChI=1S/C33H53F3O5/c1-4-5-18-25-29(41-31(38)32(40-3,33(34,35)36)28-23-19-17-20-24-28)26-21-15-13-11-9-7-6-8-10-12-14-16-22-27-30(37)39-2/h17,19-20,23-24,29H,4-16,18,21-22,25-27H2,1-3H3/t29?,32-/m1/s1
InChIKey AMZCABQCKUUOFO-CUPMVOCTSA-N
Literature Reference Author C.BOROS,B.KATZ,S.MITCHELL,C.PEARCE,K.SWINBANK,D.TAYLOR
Literature Reference Citation J.NAT.PROD.,65,108(2002)
Literature Reference DOI 10.1021/np010345a
Molecular Weight 586.776 g/mol
Solvent CDCl3
Source File Reference UWSI2709