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2-(1-BROMOETHYL)-5-METHYL-4,7,12-TRIOXO-7,12-DIHYDRO-4H-NAPHTHO-[2,3-H]-CHROMEN-11-YL-ACETATE
SpectraBase Compound ID CaD2ujeYDqQ
InChI InChI=1S/C22H15BrO6/c1-9-7-13-19(22-17(9)14(25)8-16(29-22)10(2)23)21(27)18-12(20(13)26)5-4-6-15(18)28-11(3)24/h4-8,10H,1-3H3
InChIKey PDZKFGGTQGANNS-UHFFFAOYSA-N
Mol Weight 455.26 g/mol
Molecular Formula C22H15BrO6
Exact Mass 454.005201 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5BNe24tUUXr
Name 2-(1-BROMOETHYL)-5-METHYL-4,7,12-TRIOXO-7,12-DIHYDRO-4H-NAPHTHO-[2,3-H]-CHROMEN-11-YL-ACETATE
Compound Number 13 B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H15BrO6
InChI InChI=1S/C22H15BrO6/c1-9-7-13-19(22-17(9)14(25)8-16(29-22)10(2)23)21(27)18-12(20(13)26)5-4-6-15(18)28-11(3)24/h4-8,10H,1-3H3
InChIKey PDZKFGGTQGANNS-UHFFFAOYSA-N
Literature Reference Author K.KROHN,H.T.TRAN-THIEN,I.AHMED
Literature Reference Citation EUR.J.ORG.CHEM.,2011,2223(2011)
Literature Reference DOI 10.1002/ejoc.201100093
Molecular Weight 455.262 g/mol
Solvent CDCl3
Source File Reference UWBT20904