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2,5-Dimethoxycarbonyl-3,6-bis(4-chlorophenyl)-1,4-pyrazine

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

2,5-Dimethoxycarbonyl-3,6-bis(4-chlorophenyl)-1,4-pyrazine
SpectraBase Compound ID IGuuofiQNcq
InChI InChI=1S/C20H14Cl2N2O4/c1-27-19(25)17-15(11-3-7-13(21)8-4-11)24-18(20(26)28-2)16(23-17)12-5-9-14(22)10-6-12/h3-10H,1-2H3
InChIKey LPNMEWOXOJJLPP-UHFFFAOYSA-N
Mol Weight 417.25 g/mol
Molecular Formula C20H14Cl2N2O4
Exact Mass 416.033062 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 71P1CsPv3F3
Name 2,5-Dimethoxycarbonyl-3,6-bis(4-chlorophenyl)-1,4-pyrazine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 416.033062335 u
Formula C20H14Cl2N2O4
InChI InChI=1S/C20H14Cl2N2O4/c1-27-19(25)17-15(11-3-7-13(21)8-4-11)24-18(20(26)28-2)16(23-17)12-5-9-14(22)10-6-12/h3-10H,1-2H3
InChIKey LPNMEWOXOJJLPP-UHFFFAOYSA-N
Molecular Weight 417.248 g/mol
SMILES C1(=NC(C2=CC=C(C=C2)Cl)=C(N=C1C=1C=CC(=CC1)Cl)C(=O)OC)C(=O)OC