For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

1,2-bis(4-Chlorophenyl)-4-(2,4-dimethoxyphenyl)butane-1,4-dione

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

1,2-bis(4-Chlorophenyl)-4-(2,4-dimethoxyphenyl)butane-1,4-dione
SpectraBase Compound ID JyeK61h7Lzc
InChI InChI=1S/C24H20Cl2O4/c1-29-19-11-12-20(23(13-19)30-2)22(27)14-21(15-3-7-17(25)8-4-15)24(28)16-5-9-18(26)10-6-16/h3-13,21H,14H2,1-2H3
InChIKey SMKOLPQQAVGMCA-UHFFFAOYSA-N
Mol Weight 443.33 g/mol
Molecular Formula C24H20Cl2O4
Exact Mass 442.073865 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 6ZzQUwrcQ3M
Name 1,2-bis(4-Chlorophenyl)-4-(2,4-dimethoxyphenyl)butane-1,4-dione
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 442.073864520 u
Formula C24H20Cl2O4
InChI InChI=1S/C24H20Cl2O4/c1-29-19-11-12-20(23(13-19)30-2)22(27)14-21(15-3-7-17(25)8-4-15)24(28)16-5-9-18(26)10-6-16/h3-13,21H,14H2,1-2H3
InChIKey SMKOLPQQAVGMCA-UHFFFAOYSA-N
Molecular Weight 443.326 g/mol
SMILES C=1(C(CC(C(C=2C=CC(=CC2)Cl)=O)C2=CC=C(C=C2)Cl)=O)C(=CC(=CC1)OC)OC