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(1R*,2R*)-2-[BENZYL-(TRIFLUOROACETYL)-AMINO]-BICYCLO-[3.1.0]-HEXANE-1-CARBOXYLIC-ACID;SECOND-ISOMER
SpectraBase Compound ID E14b1gerHkl
InChI InChI=1S/C16H16F3NO3/c17-16(18,19)13(21)20(9-10-4-2-1-3-5-10)12-7-6-11-8-15(11,12)14(22)23/h1-5,11-12H,6-9H2,(H,22,23)/t11?,12-,15+/m0/s1
InChIKey WYBNLTDXAVQYQZ-WQKBPTQTSA-N
Mol Weight 327.3 g/mol
Molecular Formula C16H16F3NO3
Exact Mass 327.108228 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID If5n75qrCer
Name (1R*,2R*)-2-[BENZYL-(TRIFLUOROACETYL)-AMINO]-BICYCLO-[3.1.0]-HEXANE-1-CARBOXYLIC-ACID;SECOND-ISOMER
Compound Number 31B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H16F3NO3
InChI InChI=1S/C16H16F3NO3/c17-16(18,19)13(21)20(9-10-4-2-1-3-5-10)12-7-6-11-8-15(11,12)14(22)23/h1-5,11-12H,6-9H2,(H,22,23)/t11?,12-,15+/m0/s1
InChIKey WYBNLTDXAVQYQZ-WQKBPTQTSA-N
Literature Reference Author M.MARRADI,A.BRANDI,J.MAGULL,H.SCHILL,A.D.MEIJERE
Literature Reference Citation EUR.J.ORG.CHEM.,5485(2006)
Molecular Weight 327.303 g/mol
Sample ID 32633
Solvent CDCl3