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N-[(1R,2R)-1-[(3S)-1-(2,5-dimethoxy-3,4,6-trimethyl-phenyl)-3-methyl-hex-5-en-3-yl]oxy-1-phenyl-propan-2-yl]-2,2,2-tris(fluoranyl)ethanamide
SpectraBase Compound ID Ft5I5d2gW8a
InChI InChI=1S/C29H38F3NO4/c1-9-16-28(6,17-15-23-20(4)24(35-7)18(2)19(3)25(23)36-8)37-26(22-13-11-10-12-14-22)21(5)33-27(34)29(30,31)32/h9-14,21,26H,1,15-17H2,2-8H3,(H,33,34)/t21-,26+,28-/m1/s1
InChIKey LGUUWQUDEGUQAV-UADAULAISA-N
Mol Weight 521.6 g/mol
Molecular Formula C29H38F3NO4
Exact Mass 521.275293 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4MGUMr7vNiH
Name N-[(1R,2R)-1-[(3S)-1-(2,5-dimethoxy-3,4,6-trimethyl-phenyl)-3-methyl-hex-5-en-3-yl]oxy-1-phenyl-propan-2-yl]-2,2,2-tris(fluoranyl)ethanamide
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Formula C29H38F3NO4
InChI InChI=1S/C29H38F3NO4/c1-9-16-28(6,17-15-23-20(4)24(35-7)18(2)19(3)25(23)36-8)37-26(22-13-11-10-12-14-22)21(5)33-27(34)29(30,31)32/h9-14,21,26H,1,15-17H2,2-8H3,(H,33,34)/t21-,26+,28-/m1/s1
InChIKey LGUUWQUDEGUQAV-UADAULAISA-N
Molecular Weight 521.621 g/mol
SMILES N(C(C(F)(F)F)=O)[C@@]([C@](O[C@@](CCc1c(c(C)c(c(c1C)OC)C)OC)(CC=C)C)(c1ccccc1)[H])(C)[H]
SPLASH splash10-0006-0930030000-b48463acaf2003f2ea6d
Source of Spectrum U1-1999-1082-25
Synonyms N-[(1R,2R)-1-[(3S)-1-(2,5-dimethoxy-3,4,6-trimethylphenyl)-3-methylhex-5-en-3-yl]oxy-1-phenylpropan-2-yl]-2,2,2-trifluoroacetamide N-[(1R,2R)-2-[(1S)-1-[2-(2,5-dimethoxy-3,4,6-trimethyl-phenyl)ethyl]-1-methyl-but-3-enoxy]-1-methyl-2-phenyl-ethyl]-2,2,2-trifluoro-acetamide
Wiley ID 752866