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2,4-Bis(4-chlorophenyl)-6-ethyl-5-nitrocyclohexane-1,1,3,3-tetracarbonitrile
SpectraBase Compound ID 48Z76jdVPhi
InChI InChI=1S/C24H17Cl2N5O2/c1-2-19-21(31(32)33)20(15-3-7-17(25)8-4-15)24(13-29,14-30)22(23(19,11-27)12-28)16-5-9-18(26)10-6-16/h3-10,19-22H,2H2,1H3
InChIKey NOJGNTRHKILOLR-UHFFFAOYSA-N
Mol Weight 478.34 g/mol
Molecular Formula C24H17Cl2N5O2
Exact Mass 477.07593 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GNnUOS3DIvl
Name 2,4-Bis(4-chlorophenyl)-6-ethyl-5-nitrocyclohexane-1,1,3,3-tetracarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H17Cl2N5O2
InChI InChI=1S/C24H17Cl2N5O2/c1-2-19-21(31(32)33)20(15-3-7-17(25)8-4-15)24(13-29,14-30)22(23(19,11-27)12-28)16-5-9-18(26)10-6-16/h3-10,19-22H,2H2,1H3
InChIKey NOJGNTRHKILOLR-UHFFFAOYSA-N
Molecular Weight 478.339 g/mol
SMILES C1(C(C(N(=O)=O)C(C(C1c1ccc(cc1)Cl)(C#N)C#N)CC)c1ccc(cc1)Cl)(C#N)C#N
SPLASH splash10-0f80-9700000000-cfe78fa26fc5cb564fba
Source of Spectrum U1-2008-6172-3d
Wiley ID 1662338