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1,2-Benzenediol, o-(4-chlorobenzoyl)-o'-(4-nitrobenzoyl)-

View entire compound with spectra: 1 NMR

1,2-Benzenediol, o-(4-chlorobenzoyl)-o'-(4-nitrobenzoyl)-
SpectraBase Compound ID 8NxLUKRXEPg
InChI InChI=1S/C20H12ClNO6/c21-15-9-5-13(6-10-15)19(23)27-17-3-1-2-4-18(17)28-20(24)14-7-11-16(12-8-14)22(25)26/h1-12H
InChIKey MLZBPSQRSSDNNS-UHFFFAOYSA-N
Mol Weight 397.77 g/mol
Molecular Formula C20H12ClNO6
Exact Mass 397.035315 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L7sjPsZaSCe
Name 1,2-Benzenediol, o-(4-chlorobenzoyl)-o'-(4-nitrobenzoyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 397.035314804 u
Formula C20H12ClNO6
InChI InChI=1S/C20H12ClNO6/c21-15-9-5-13(6-10-15)19(23)27-17-3-1-2-4-18(17)28-20(24)14-7-11-16(12-8-14)22(25)26/h1-12H
InChIKey MLZBPSQRSSDNNS-UHFFFAOYSA-N
Molecular Weight 397.770 g/mol
SMILES C1(=CC=CC=C1OC(=O)C1=CC=C(C=C1)N(=O)=O)OC(=O)C1=CC=C(C=C1)Cl