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1,2-Benzenediol, o,o'-di(4-butylbenzoyl)-

View entire compound with spectra: 1 NMR

1,2-Benzenediol, o,o'-di(4-butylbenzoyl)-
SpectraBase Compound ID Ey7CIey1ei6
InChI InChI=1S/C28H30O4/c1-3-5-9-21-13-17-23(18-14-21)27(29)31-25-11-7-8-12-26(25)32-28(30)24-19-15-22(16-20-24)10-6-4-2/h7-8,11-20H,3-6,9-10H2,1-2H3
InChIKey KRGQENTYYWEFJD-UHFFFAOYSA-N
Mol Weight 430.54 g/mol
Molecular Formula C28H30O4
Exact Mass 430.214409 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AlVu54XJF8N
Name 1,2-Benzenediol, o,o'-di(4-butylbenzoyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 430.214409442 u
Formula C28H30O4
InChI InChI=1S/C28H30O4/c1-3-5-9-21-13-17-23(18-14-21)27(29)31-25-11-7-8-12-26(25)32-28(30)24-19-15-22(16-20-24)10-6-4-2/h7-8,11-20H,3-6,9-10H2,1-2H3
InChIKey KRGQENTYYWEFJD-UHFFFAOYSA-N
Molecular Weight 430.544 g/mol
SMILES CCCCC1=CC=C(C(OC=2C(=CC=CC2)OC(=O)C2=CC=C(C=C2)CCCC)=O)C=C1