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5-(Dicyanomethylene)tetracyclo[7.6.0.0(8,13).2(2,6)]pentadecapentaene
SpectraBase Compound ID IegPFNU3Oza
InChI InChI=1S/C18H12N2/c19-9-12(10-20)13-7-5-11-6-8-16(13)18-15-4-2-1-3-14(15)17(11)18/h1-8,11,16-18H/t11?,16?,17-,18?/m1/s1
InChIKey GXPUSZHQKHUCKL-WJBRIVKMSA-N
Mol Weight 256.31 g/mol
Molecular Formula C18H12N2
Exact Mass 256.100048 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 47u8dPTFCK
Name 5-(Dicyanomethylene)tetracyclo[7.6.0.0(8,13).2(2,6)]pentadecapentaene
Comments Less than 3 mono-isotopic peaks
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Formula C18H12N2
InChI InChI=1S/C18H12N2/c19-9-12(10-20)13-7-5-11-6-8-16(13)18-15-4-2-1-3-14(15)17(11)18/h1-8,11,16-18H/t11?,16?,17-,18?/m1/s1
InChIKey GXPUSZHQKHUCKL-WJBRIVKMSA-N
Molecular Weight 256.308 g/mol
SMILES C12C3C(=C(C#N)C#N)C=CC(C=C3)[C@@]1(c1c2cccc1)[H]
SPLASH splash10-052f-0090000000-4a8bea500d33266beaeb
Source of Spectrum E1-40-2832-3
Wiley ID 1551742