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1,3-Benzenediol, o-(4-ethylbenzoyl)-o'-(3-methylbenzoyl)-
SpectraBase Compound ID 8sl4UllPli
InChI InChI=1S/C23H20O4/c1-3-17-10-12-18(13-11-17)22(24)26-20-8-5-9-21(15-20)27-23(25)19-7-4-6-16(2)14-19/h4-15H,3H2,1-2H3
InChIKey RHXPPIVDRBRSNX-UHFFFAOYSA-N
Mol Weight 360.41 g/mol
Molecular Formula C23H20O4
Exact Mass 360.136159 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BbnuwKegGc6
Name 1,3-Benzenediol, o-(4-ethylbenzoyl)-o'-(3-methylbenzoyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 360.136159120 u
Formula C23H20O4
InChI InChI=1S/C23H20O4/c1-3-17-10-12-18(13-11-17)22(24)26-20-8-5-9-21(15-20)27-23(25)19-7-4-6-16(2)14-19/h4-15H,3H2,1-2H3
InChIKey RHXPPIVDRBRSNX-UHFFFAOYSA-N
Molecular Weight 360.409 g/mol
SMILES C1=C(C=CC=C1OC(C1=CC=C(CC)C=C1)=O)OC(=O)C1=CC(C)=CC=C1