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4-(19,19,20,20-tetracyanocyclobutanyl)[2.2]paracyclophane
SpectraBase Compound ID Cv5YBdZCUvP
InChI InChI=1S/C24H18N4/c25-13-23(14-26)12-22(24(23,15-27)16-28)21-11-19-6-5-17-1-3-18(4-2-17)7-9-20(21)10-8-19/h1-4,8,10-11,22H,5-7,9,12H2/t22-/m1/s1
InChIKey ODXYGCXXLBZDFZ-JOCHJYFZSA-N
Mol Weight 362.44 g/mol
Molecular Formula C24H18N4
Exact Mass 362.153147 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HmOIlFDPDv4
Name 4-(19,19,20,20-tetracyanocyclobutanyl)[2.2]paracyclophane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H18N4
InChI InChI=1S/C24H18N4/c25-13-23(14-26)12-22(24(23,15-27)16-28)21-11-19-6-5-17-1-3-18(4-2-17)7-9-20(21)10-8-19/h1-4,8,10-11,22H,5-7,9,12H2/t22-/m1/s1
InChIKey ODXYGCXXLBZDFZ-JOCHJYFZSA-N
Molecular Weight 362.436 g/mol
SMILES C1(C(C#N)(C#N)C[C@@]1(c1c2CCc3ccc(CCc(c1)cc2)cc3)[H])(C#N)C#N
SPLASH splash10-0udi-0900000000-4bff77fbd4f650b6f4ae
Source of Spectrum K1-2-346-39
Wiley ID 1588177