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NLXLKWUHGGLPLN-XINAWCOVSA-N
SpectraBase Compound ID CD3SCc1ucVq
InChI InChI=1S/C9H12F3NO4/c1-8(2,16)6-4(3-5(14)17-6)13-7(15)9(10,11)12/h4,6,16H,3H2,1-2H3,(H,13,15)/t4-,6+/m1/s1
InChIKey NLXLKWUHGGLPLN-XINAWCOVSA-N
Mol Weight 255.19 g/mol
Molecular Formula C9H12F3NO4
Exact Mass 255.071842 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3xMSzK2uWaf
Name NLXLKWUHGGLPLN-XINAWCOVSA-N
CAS Registry Number 82010-45-5
Compound Number 13B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H12F3NO4
InChI InChI=1S/C9H12F3NO4/c1-8(2,16)6-4(3-5(14)17-6)13-7(15)9(10,11)12/h4,6,16H,3H2,1-2H3,(H,13,15)/t4-,6+/m1/s1
InChIKey NLXLKWUHGGLPLN-XINAWCOVSA-N
Literature Reference Author G.FRONZA,C.FUGANTI,P.GRASSELLI,L.MAJORI,G.PEDROCCHI-FANTONI, F.SPREAFICO
Literature Reference Citation J.ORG.CHEM.,47,3289(1982)
Literature Reference DOI 10.1021/jo00138a018
Molecular Weight 255.194 g/mol
Solvent CDCl3
Source File Reference UWCS10116