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2-(2,4-Dibromo-phenoxy)-N-(1,3-dioxo-1H,3H-benzo[de]isoquinolin-2-yl)-acetamide

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2-(2,4-Dibromo-phenoxy)-N-(1,3-dioxo-1H,3H-benzo[de]isoquinolin-2-yl)-acetamide
SpectraBase Compound ID Gu7SYpd7UYE
InChI InChI=1S/C20H12Br2N2O4/c21-12-7-8-16(15(22)9-12)28-10-17(25)23-24-19(26)13-5-1-3-11-4-2-6-14(18(11)13)20(24)27/h1-9H,10H2,(H,23,25)
InChIKey CSTOPWNLMNNKGZ-UHFFFAOYSA-N
Mol Weight 504.13 g/mol
Molecular Formula C20H12Br2N2O4
Exact Mass 501.916383 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GqgXlseq6UA
Name 2-(2,4-Dibromo-phenoxy)-N-(1,3-dioxo-1H,3H-benzo[de]isoquinolin-2-yl)-acetamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 501.916382870 u
Formula C20H12Br2N2O4
InChI InChI=1S/C20H12Br2N2O4/c21-12-7-8-16(15(22)9-12)28-10-17(25)23-24-19(26)13-5-1-3-11-4-2-6-14(18(11)13)20(24)27/h1-9H,10H2,(H,23,25)
InChIKey CSTOPWNLMNNKGZ-UHFFFAOYSA-N
Molecular Weight 504.134 g/mol
SMILES C1(=C(C=CC(=C1)Br)OCC(NN1C(C2=CC=CC3=C2C(=CC=C3)C1=O)=O)=O)Br