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5,5,6,6-Tetracyano-4,9-[2,2'-(phenyl-1,4-diyl)diethano]cyclo[2.2.2]octane
SpectraBase Compound ID KqlY4Fjs74z
InChI InChI=1S/C22H22N4/c23-11-21(12-24)19-9-17-7-5-15-1-2-16(4-3-15)6-8-18(10-19)20(17)22(21,13-25)14-26/h9-10,15-16,19-20H,1-8H2
InChIKey QWLYHCBHAHZWTN-UHFFFAOYSA-N
Mol Weight 342.45 g/mol
Molecular Formula C22H22N4
Exact Mass 342.184447 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2knBLhIpGZf
Name 5,5,6,6-Tetracyano-4,9-[2,2'-(phenyl-1,4-diyl)diethano]cyclo[2.2.2]octane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H22N4
InChI InChI=1S/C22H22N4/c23-11-21(12-24)19-9-17-7-5-15-1-2-16(4-3-15)6-8-18(10-19)20(17)22(21,13-25)14-26/h9-10,15-16,19-20H,1-8H2
InChIKey QWLYHCBHAHZWTN-UHFFFAOYSA-N
Molecular Weight 342.446 g/mol
SMILES C1(C(C2C=C3C1C(=C2)CCC1CCC(CC3)CC1)(C#N)C#N)(C#N)C#N
SPLASH splash10-0udi-2900000000-700ca7b42801bb857f28
Source of Spectrum J-62-8943-12
Wiley ID 1336908