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Undecacyclo[9.9.0.0(2,9).0(3,7).0(4,20).0(5,18).0(6,16).0(8,15).0(10,14).0(12,19).0(13,17)]icosane-1,6-dicarbonitrile
SpectraBase Compound ID 3jwYHvMTUfV
InChI InChI=1S/C22H18N2/c23-1-21-15-5-3-4-6(15)10-12-8(4)16-7(3)11-9(5)17(21)13-14(18(10)21)20(12)22(16,2-24)19(11)13/h3-20H
InChIKey QOYMWXLTMBWVIW-UHFFFAOYSA-N
Mol Weight 310.4 g/mol
Molecular Formula C22H18N2
Exact Mass 310.146999 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HeQz2kcwLqw
Name Undecacyclo[9.9.0.0(2,9).0(3,7).0(4,20).0(5,18).0(6,16).0(8,15).0(10,14).0(12,19).0(13,17)]icosane-1,6-dicarbonitrile
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H18N2
InChI InChI=1S/C22H18N2/c23-1-21-15-5-3-4-6(15)10-12-8(4)16-7(3)11-9(5)17(21)13-14(18(10)21)20(12)22(16,2-24)19(11)13/h3-20H
InChIKey QOYMWXLTMBWVIW-UHFFFAOYSA-N
Molecular Weight 310.400 g/mol
SMILES C12(C3C4C5C6C3C3C1C1C7C3C6C3C5C5C4C2C1C5C73C#N)C#N
SPLASH splash10-03di-0009000000-0894a7f8b1024673bf04
Source of Spectrum KC-0-1197-19
Wiley ID 825195