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TERT.-BUTYL-(S)-3-[METHOXY-(TRIFLUOAREMETHYL)-PHENYL-ACETIC-ACID]-3-(4-NITROPHENYL)-PROPANOATE
SpectraBase Compound ID 2ZGMbXXGgei
InChI InChI=1S/C23H24F3NO7/c1-21(2,3)34-19(28)14-18(15-10-12-17(13-11-15)27(30)31)33-20(29)22(32-4,23(24,25)26)16-8-6-5-7-9-16/h5-13,18H,14H2,1-4H3/t18-,22+/m0/s1
InChIKey XIRIAGBDRCHODE-PGRDOPGGSA-N
Mol Weight 483.44 g/mol
Molecular Formula C23H24F3NO7
Exact Mass 483.150487 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IDGirvdNUnM
Name TERT.-BUTYL-(S)-3-[METHOXY-(TRIFLUOAREMETHYL)-PHENYL-ACETIC-ACID]-3-(4-NITROPHENYL)-PROPANOATE
Compound Number ( S)-2E-(R)-MTPA
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H24F3NO7
InChI InChI=1S/C23H24F3NO7/c1-21(2,3)34-19(28)14-18(15-10-12-17(13-11-15)27(30)31)33-20(29)22(32-4,23(24,25)26)16-8-6-5-7-9-16/h5-13,18H,14H2,1-4H3/t18-,22+/m0/s1
InChIKey XIRIAGBDRCHODE-PGRDOPGGSA-N
Literature Reference Author A.E.DIAZ-ALVAREZ,L.MESAS-SANCHEZ,P.DINER
Literature Reference Citation MOLECULES,19,14273(2014)
Literature Reference DOI 10.3390/molecules190914273
Solvent Unknown
Source File Reference UWIR15394