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4,5,12,13-Tetrakis(cyanomethyl)-[2.2]paracyclophane
SpectraBase Compound ID Ewh9SsNVjBi
InChI InChI=1S/C24H20N4/c25-13-9-21-17-1-2-18(22(21)10-14-26)7-8-20-4-3-19(6-5-17)23(11-15-27)24(20)12-16-28/h1-4H,5-12H2
InChIKey QKAVEINNMFUTQY-UHFFFAOYSA-N
Mol Weight 364.45 g/mol
Molecular Formula C24H20N4
Exact Mass 364.168797 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J8lGBzqJTov
Name 4,5,12,13-Tetrakis(cyanomethyl)-[2.2]paracyclophane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H20N4
InChI InChI=1S/C24H20N4/c25-13-9-21-17-1-2-18(22(21)10-14-26)7-8-20-4-3-19(6-5-17)23(11-15-27)24(20)12-16-28/h1-4H,5-12H2
InChIKey QKAVEINNMFUTQY-UHFFFAOYSA-N
Molecular Weight 364.452 g/mol
SMILES c1(c(c2CCc3c(c(c(CCc1cc2)cc3)CC#N)CC#N)CC#N)CC#N
SPLASH splash10-001i-0902000000-d68a73d875d007c4a059
Source of Spectrum J-62-7647-20
Synonyms [6,11,12-tris(cyanomethyl)tricyclo[8.2.2.2(4,7)]hexadeca-1(12),4,6,10,13,15-hexaen-5-yl]acetonitrile
Wiley ID 1351138