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Tricyclo[10.2.2.2(5,8)]octadeca-5,7,12,14,15,17-hexaene-2,2,11,11-tetra carbonitrile
SpectraBase Compound ID FwVq5m4T2MZ
InChI InChI=1S/C22H16N4/c23-13-21(14-24)11-9-17-1-2-18(4-3-17)10-12-22(15-25,16-26)20-7-5-19(21)6-8-20/h1-8H,9-12H2
InChIKey QKEWMKNUPFFOID-UHFFFAOYSA-N
Mol Weight 336.4 g/mol
Molecular Formula C22H16N4
Exact Mass 336.137497 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1XBESger5M
Name Tricyclo[10.2.2.2(5,8)]octadeca-5,7,12,14,15,17-hexaene-2,2,11,11-tetra carbonitrile
CAS Registry Number 65649-18-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H16N4
InChI InChI=1S/C22H16N4/c23-13-21(14-24)11-9-17-1-2-18(4-3-17)10-12-22(15-25,16-26)20-7-5-19(21)6-8-20/h1-8H,9-12H2
InChIKey QKEWMKNUPFFOID-UHFFFAOYSA-N
Molecular Weight 336.398 g/mol
SMILES C1(C#N)(C#N)c2ccc(C(C#N)(C#N)CCc3ccc(CC1)cc3)cc2
SPLASH splash10-00li-1905000000-ebea765f99f82b047d03
Source of Spectrum C-100-1813-0
Synonyms 5,5,14,14-tetracyanotricyclo[14.2.2]octadeca-1,3,8,10,15,17-hexene 4,4,9,9-Tetracyanotricyclo[10.2.2.2(5,8)]octadeca-5,7,12,14,15,17-hexene Tricyclo[10.2.2.2(5,8)]octadeca-1(14),5,7,12,15,17-hexaene-2,2,11,11-tetracarbonitrile
Wiley ID 1332737