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(1.alpha.,2.alpha.,3.beta.,4.beta.)-1,2-bis(3-chloro-2-quinoxalinyl)-3,4-bis(4-cyanophenyl)cyclobutane
SpectraBase Compound ID FUfrpVJzuIM
InChI InChI=1S/C34H20Cl2N6/c35-33-31(39-23-5-1-3-7-25(23)41-33)29-27(21-13-9-19(17-37)10-14-21)28(22-15-11-20(18-38)12-16-22)30(29)32-34(36)42-26-8-4-2-6-24(26)40-32/h1-16,27-30H/t27-,28+,29+,30-
InChIKey LVHCJZSSYSGUBP-LPOKLPNDSA-N
Mol Weight 583.5 g/mol
Molecular Formula C34H20Cl2N6
Exact Mass 582.11265 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7yNIngH3Ecz
Name (1.alpha.,2.alpha.,3.beta.,4.beta.)-1,2-bis(3-chloro-2-quinoxalinyl)-3,4-bis(4-cyanophenyl)cyclobutane
CAS Registry Number 115984-34-4
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H20Cl2N6
InChI InChI=1S/C34H20Cl2N6/c35-33-31(39-23-5-1-3-7-25(23)41-33)29-27(21-13-9-19(17-37)10-14-21)28(22-15-11-20(18-38)12-16-22)30(29)32-34(36)42-26-8-4-2-6-24(26)40-32/h1-16,27-30H/t27-,28+,29+,30-
InChIKey LVHCJZSSYSGUBP-LPOKLPNDSA-N
Molecular Weight 583.482 g/mol
SMILES c1([C@]2([C@@](c3nc4ccccc4nc3Cl)([C@@]([C@@]2(c2ccc(C#N)cc2)[H])(c2ccc(C#N)cc2)[H])[H])[H])nc2ccccc2nc1Cl
SPLASH splash10-0006-0090020000-c5d3d678fa4fd4f7ba1c
Source of Spectrum K-121-2142-8
Synonyms 4-[(1S,2R,3S,4R)-2,3-bis(3-chloro-2-quinoxalinyl)-4-(4-cyanophenyl)cyclobutyl]benzonitrile
Wiley ID 1408666