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QTPZEZJWADUQIZ-OEQMFVPNSA-N
SpectraBase Compound ID LIfNIUH9YKd
InChI InChI=1S/C22H21F3N2O5/c1-4-11-10-26(20(29)22(23,24)25)15-9-13(11)17(19(28)31-2)16-12-7-5-6-8-14(12)27(18(15)16)21(30)32-3/h4-8,13,15,17H,9-10H2,1-3H3/b11-4-/t13-,15-,17-/m0/s1
InChIKey QTPZEZJWADUQIZ-OEQMFVPNSA-N
Mol Weight 450.41 g/mol
Molecular Formula C22H21F3N2O5
Exact Mass 450.140256 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EL9dnT4ojhg
Name QTPZEZJWADUQIZ-OEQMFVPNSA-N
Compound Number 22
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H21F3N2O5
InChI InChI=1S/C22H21F3N2O5/c1-4-11-10-26(20(29)22(23,24)25)15-9-13(11)17(19(28)31-2)16-12-7-5-6-8-14(12)27(18(15)16)21(30)32-3/h4-8,13,15,17H,9-10H2,1-3H3/b11-4-/t13-,15-,17-/m0/s1
InChIKey QTPZEZJWADUQIZ-OEQMFVPNSA-N
Literature Reference Author M.L.BENNASAR,E.ZULAICA,A.RAMIREZ,J.BOSCH
Literature Reference Citation J.ORG.CHEM.,61,1239(1996)
Literature Reference DOI 10.1021/jo951456f
Molecular Weight 450.414 g/mol
Solvent CDCl3
Source File Reference UWGE1555