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XRXCDPYIRLDSAU-UHFFFAOYSA-N

View entire compound with spectra: 1 NMR

XRXCDPYIRLDSAU-UHFFFAOYSA-N
SpectraBase Compound ID 3YJyCALLHFl
InChI InChI=1S/C18H37NO2.C2HF3O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(20)21-17-16-19;3-2(4,5)1(6)7/h2-17,19H2,1H3;(H,6,7)
InChIKey XRXCDPYIRLDSAU-UHFFFAOYSA-N
Mol Weight 413.5 g/mol
Molecular Formula C20H38F3NO4
Exact Mass 413.275293 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AC8SZmobMjY
Name XRXCDPYIRLDSAU-UHFFFAOYSA-N
Compound Number 2A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H38F3NO4
InChI InChI=1S/C18H37NO2.C2HF3O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(20)21-17-16-19;3-2(4,5)1(6)7/h2-17,19H2,1H3;(H,6,7)
InChIKey XRXCDPYIRLDSAU-UHFFFAOYSA-N
Literature Reference Author R.OTTRIA,S.CASATI,P.CIUFFREDA
Literature Reference Citation MAGN.RES.CHEM.,50,823(2012)
Literature Reference DOI 10.1002/mrc.3891
Molecular Weight 413.521 g/mol
Solvent CDCl3
Source File Reference UWLU82424