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DL-Tyrosine, 3-methoxy-O,.alpha.-dimethyl-N-(3,3,3-trifluoro-2-methoxy-1-oxo-2-phenylpropyl)-, methyl ester, (S)-
SpectraBase Compound ID FEYfVUNpapx
InChI InChI=1S/C23H26F3NO6/c1-21(20(29)32-4,14-15-11-12-17(30-2)18(13-15)31-3)27-19(28)22(33-5,23(24,25)26)16-9-7-6-8-10-16/h6-13H,14H2,1-5H3,(H,27,28)/t21?,22-/m0/s1
InChIKey ODNPZFXOURDQDD-KEKNWZKVSA-N
Mol Weight 469.46 g/mol
Molecular Formula C23H26F3NO6
Exact Mass 469.171222 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1rohZdF42S
Name DL-Tyrosine, 3-methoxy-O,.alpha.-dimethyl-N-(3,3,3-trifluoro-2-methoxy-1-oxo-2-phenylpropyl)-, methyl ester, (S)-
CAS Registry Number 67472-41-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H26F3NO6
InChI InChI=1S/C23H26F3NO6/c1-21(20(29)32-4,14-15-11-12-17(30-2)18(13-15)31-3)27-19(28)22(33-5,23(24,25)26)16-9-7-6-8-10-16/h6-13H,14H2,1-5H3,(H,27,28)/t21?,22-/m0/s1
InChIKey ODNPZFXOURDQDD-KEKNWZKVSA-N
Molecular Weight 469.457 g/mol
SMILES N(C(C(=O)OC)(Cc1cc(OC)c(cc1)OC)C)C([C@](C(F)(F)F)(c1ccccc1)OC)=O
SPLASH splash10-0f79-0950000000-aa6756aeb4c66a7bbe6d
Source of Spectrum KO-5-35-1
Synonyms Methyl 3-(3,4-dimethoxyphenyl)-2-methyl-2-{[(2S)-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl]amino}propanoate N-((S)-.alpha.-methoxy-.alpha.(trifluoromethyl)phenyl acetoxy-.alpha.-methyl-3,4-dimethoxy phenylalanine methyl ester
Wiley ID 1392616