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1,2-Benzenediol, o-(2-chlorobenzoyl)-o'-(4-methylbenzoyl)-
SpectraBase Compound ID H6NnNwtWZXG
InChI InChI=1S/C21H15ClO4/c1-14-10-12-15(13-11-14)20(23)25-18-8-4-5-9-19(18)26-21(24)16-6-2-3-7-17(16)22/h2-13H,1H3
InChIKey XGKCMRCXVXRHSM-UHFFFAOYSA-N
Mol Weight 366.8 g/mol
Molecular Formula C21H15ClO4
Exact Mass 366.065887 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B6KmzSfgAWO
Name 1,2-Benzenediol, o-(2-chlorobenzoyl)-o'-(4-methylbenzoyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 366.065886659 u
Formula C21H15ClO4
InChI InChI=1S/C21H15ClO4/c1-14-10-12-15(13-11-14)20(23)25-18-8-4-5-9-19(18)26-21(24)16-6-2-3-7-17(16)22/h2-13H,1H3
InChIKey XGKCMRCXVXRHSM-UHFFFAOYSA-N
Molecular Weight 366.800 g/mol
SMILES CC1=CC=C(C(OC=2C(=CC=CC2)OC(C2=CC=CC=C2Cl)=O)=O)C=C1