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2-Methyl-1,3-dioxo-4-phenyl-3a,4,11a,11b-tetrahydropyrrolo[3,4-c]xanthone
SpectraBase Compound ID B20QwIaadzz
InChI InChI=1S/C22H17NO4/c1-23-21(25)17-14(12-7-3-2-4-8-12)11-15-19(24)13-9-5-6-10-16(13)27-20(15)18(17)22(23)26/h2-11,14,17-18,20H,1H3/t14-,17-,18-,20-/m1/s1
InChIKey MEZPCFKYDXROSU-VXXKDZQQSA-N
Mol Weight 359.38 g/mol
Molecular Formula C22H17NO4
Exact Mass 359.115758 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9dKOTBE5Po0
Name 2-METHYL-1,3-DIOXO-4-PHENYL-3A,4,11A,11B-TETRAHYDROPYRROLO-[3,4-C]-XANTHONE
Compound Number 13A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H17NO4
InChI InChI=1S/C22H17NO4/c1-23-21(25)17-14(12-7-3-2-4-8-12)11-15-19(24)13-9-5-6-10-16(13)27-20(15)18(17)22(23)26/h2-11,14,17-18,20H,1H3/t14-,17-,18-,20-/m1/s1
InChIKey MEZPCFKYDXROSU-VXXKDZQQSA-N
Literature Reference Author D.C.G.A.PINTO,A.M.S.SILVA,C.M.BRITA,A.SANDULACHE,J.R.CARRILL O,P.PRIETO,A.DIAZ-OR
Literature Reference Citation EUR.J.ORG.CHEM.,2973(2005)
Literature Reference DOI 10.1002/ejoc.200500073
Molecular Weight 359.381 g/mol
Sample ID 29759
Solvent CDCl3