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ABGPZYZIAJGJAT-NQIIRXRSSA-N
SpectraBase Compound ID DMNc62HgS64
InChI InChI=1S/C21H22ClFN2O2/c1-4-24(5-2)20(26)21(3)18(17-15(22)12-9-13-16(17)23)19(25(21)27)14-10-7-6-8-11-14/h6-13,18H,4-5H2,1-3H3/t18-,21+/m1/s1
InChIKey ABGPZYZIAJGJAT-NQIIRXRSSA-N
Mol Weight 388.87 g/mol
Molecular Formula C21H22ClFN2O2
Exact Mass 388.135384 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EPF0ND5vaWW
Name ABGPZYZIAJGJAT-NQIIRXRSSA-N
Compound Number 9G
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H22ClFN2O2
InChI InChI=1S/C21H22ClFN2O2/c1-4-24(5-2)20(26)21(3)18(17-15(22)12-9-13-16(17)23)19(25(21)27)14-10-7-6-8-11-14/h6-13,18H,4-5H2,1-3H3/t18-,21+/m1/s1
InChIKey ABGPZYZIAJGJAT-NQIIRXRSSA-N
Literature Reference Author P.J.S.S.VAN-EIJK,C.OVERKEMPE,W.P.TROMPENAARS,D.N.REINHOUDT,L .M.MANNINEN,G.J.VAN-
Literature Reference Citation REC.TR.CH.P.-B.,107,27(1988)
Literature Reference DOI 10.1002/recl.19881070202
Molecular Weight 388.869 g/mol
Solvent CDCl3
Source File Reference UNIW21068