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(2S*,3AS*)-2-HYDROXY-3A-METHYL-2-(TRIFLUOROMETHYL)-3,3A,4,5-TETRAHYDROPYRROLO-[1,2-A]-QUINAZOLIN-1(2H)-ONE
SpectraBase Compound ID BjZVsEw5tsR
InChI InChI=1S/C13H13F3N2O2/c1-11-7-12(20,13(14,15)16)10(19)18(11)9-5-3-2-4-8(9)6-17-11/h2-5,17,20H,6-7H2,1H3/t11-,12-/m0/s1
InChIKey LRGBCXCKZGOORL-RYUDHWBXSA-N
Mol Weight 286.25 g/mol
Molecular Formula C13H13F3N2O2
Exact Mass 286.092912 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Cmxa3JuyeXK
Name (2S*,3AS*)-2-HYDROXY-3A-METHYL-2-(TRIFLUOROMETHYL)-3,3A,4,5-TETRAHYDROPYRROLO-[1,2-A]-QUINAZOLIN-1(2H)-ONE
Compound Number 5C(CIS)
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H13F3N2O2
InChI InChI=1S/C13H13F3N2O2/c1-11-7-12(20,13(14,15)16)10(19)18(11)9-5-3-2-4-8(9)6-17-11/h2-5,17,20H,6-7H2,1H3/t11-,12-/m0/s1
InChIKey LRGBCXCKZGOORL-RYUDHWBXSA-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)
Molecular Weight 286.254 g/mol
Solvent ACETONE-D6
Source File Reference UWIR16495