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(3E)-1-(4-Chlorobenzoyl)-1H-indole-2,3-dione 3-[o-(4-chlorobenzoyl)oxime]
SpectraBase Compound ID 2DPisnxXP9i
InChI InChI=1S/C22H12Cl2N2O4/c23-15-9-5-13(6-10-15)20(27)26-18-4-2-1-3-17(18)19(21(26)28)25-30-22(29)14-7-11-16(24)12-8-14/h1-12H/b25-19+
InChIKey KWPTXSVZPDKZJL-NCELDCMTSA-N
Mol Weight 439.25 g/mol
Molecular Formula C22H12Cl2N2O4
Exact Mass 438.017412 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID z912T3Zyrm
Name (3E)-1-(4-Chlorobenzoyl)-1H-indole-2,3-dione 3-[o-(4-chlorobenzoyl)oxime]
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 438.017412270 u
Formula C22H12Cl2N2O4
InChI InChI=1S/C22H12Cl2N2O4/c23-15-9-5-13(6-10-15)20(27)26-18-4-2-1-3-17(18)19(21(26)28)25-30-22(29)14-7-11-16(24)12-8-14/h1-12H/b25-19+
InChIKey KWPTXSVZPDKZJL-NCELDCMTSA-N
Molecular Weight 439.254 g/mol
SMILES C=1C=CC=2N(C(\C(=N\OC(C=3C=CC(=CC3)Cl)=O)C2C1)=O)C(C=1C=CC(=CC1)Cl)=O