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2,5-bis(Chloranyl)-3,6-bis(4-ethylpiperazin-1-yl)cyclohexa-2,5-diene-1,4-dione

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2,5-bis(Chloranyl)-3,6-bis(4-ethylpiperazin-1-yl)cyclohexa-2,5-diene-1,4-dione
SpectraBase Compound ID AedWwvDOQhm
InChI InChI=1S/C18H26Cl2N4O2/c1-3-21-5-9-23(10-6-21)15-13(19)18(26)16(14(20)17(15)25)24-11-7-22(4-2)8-12-24/h3-12H2,1-2H3
InChIKey FDGTZKCTUSEFEA-UHFFFAOYSA-N
Mol Weight 401.34 g/mol
Molecular Formula C18H26Cl2N4O2
Exact Mass 400.143281 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6Soqx6Vvbd9
Name 2,5-bis(Chloranyl)-3,6-bis(4-ethylpiperazin-1-yl)cyclohexa-2,5-diene-1,4-dione
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 400.143281491 u
Formula C18H26Cl2N4O2
InChI InChI=1S/C18H26Cl2N4O2/c1-3-21-5-9-23(10-6-21)15-13(19)18(26)16(14(20)17(15)25)24-11-7-22(4-2)8-12-24/h3-12H2,1-2H3
InChIKey FDGTZKCTUSEFEA-UHFFFAOYSA-N
Molecular Weight 401.338 g/mol
SMILES C1(=C(C(=O)C(=C(C1=O)Cl)N1CCN(CC1)CC)Cl)N1CCN(CC1)CC