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(2R*,3AS*)-2-HYDROXY-2-(TRIFLUOROMETHYL)-3,3A,4,9-TETRAHYDROPYRROLO-[2,1-B]-QUINAZOLIN-1(2H)-ONE
SpectraBase Compound ID mAN4byrNrl
InChI InChI=1S/C12H11F3N2O2/c13-12(14,15)11(19)5-9-16-8-4-2-1-3-7(8)6-17(9)10(11)18/h1-4,9,16,19H,5-6H2/t9-,11+/m0/s1
InChIKey HDOXLDUEEYJVDJ-GXSJLCMTSA-N
Mol Weight 272.23 g/mol
Molecular Formula C12H11F3N2O2
Exact Mass 272.077262 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4pAx57Kpazw
Name (2R*,3AS*)-2-HYDROXY-2-(TRIFLUOROMETHYL)-3,3A,4,9-TETRAHYDROPYRROLO-[2,1-B]-QUINAZOLIN-1(2H)-ONE
Compound Number 4A(TRANS)
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H11F3N2O2
InChI InChI=1S/C12H11F3N2O2/c13-12(14,15)11(19)5-9-16-8-4-2-1-3-7(8)6-17(9)10(11)18/h1-4,9,16,19H,5-6H2/t9-,11+/m0/s1
InChIKey HDOXLDUEEYJVDJ-GXSJLCMTSA-N
Literature Reference Author B.DOLENSKY,J.KVICALA,O.PALETA,J.LANG,H.DVORAKOVA,J.CEJKA
Literature Reference Citation MAGN.RES.CHEM.,48,375(2010)
Solvent ACETONE-D6
Source File Reference UWIR16488