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2-oxo-2-phenylethyl [2-(4-bromophenyl)-6,6-dimethyl-4-oxo-4,5,6,7-tetrahydro-1H-indol-1-yl]acetate
SpectraBase Compound ID 14ePcdG5V2A
InChI InChI=1S/C26H24BrNO4/c1-26(2)13-22-20(23(29)14-26)12-21(17-8-10-19(27)11-9-17)28(22)15-25(31)32-16-24(30)18-6-4-3-5-7-18/h3-12H,13-16H2,1-2H3
InChIKey PNMCWRLOLACDKZ-UHFFFAOYSA-N
Mol Weight 494.39 g/mol
Molecular Formula C26H24BrNO4
Exact Mass 493.088871 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6oJtkh4c8bH
Name 2-oxo-2-Phenylethyl [2-(4-bromophenyl)-6,6-dimethyl-4-oxo-4,5,6,7-tetrahydro-1H-indol-1-yl]acetate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 493.088871253 u
Formula C26H24BrNO4
InChI InChI=1S/C26H24BrNO4/c1-26(2)13-22-20(23(29)14-26)12-21(17-8-10-19(27)11-9-17)28(22)15-25(31)32-16-24(30)18-6-4-3-5-7-18/h3-12H,13-16H2,1-2H3
InChIKey PNMCWRLOLACDKZ-UHFFFAOYSA-N
Molecular Weight 494.385 g/mol
SMILES C1=CC=C(C(COC(CN2C3=C(C(=O)CC(C3)(C)C)C=C2C=2C=CC(=CC2)Br)=O)=O)C=C1