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anti-1,4,5,8,8a,10a-hexahydro-1,4:5,8-dimethanophenanthrene-9,9,10,10-tetracarbonitrile
SpectraBase Compound ID GYIIuRZH4cE
InChI InChI=1S/C20H14N4/c21-7-19(8-22)17-13-3-1-11(5-13)15(17)16-12-2-4-14(6-12)18(16)20(19,9-23)10-24/h1-4,11-14,17-18H,5-6H2/t11-,12-,13+,14+,17-,18+/m0/s1
InChIKey AYYFWPQVRUSVPZ-QFQJSSFHSA-N
Mol Weight 310.36 g/mol
Molecular Formula C20H14N4
Exact Mass 310.121846 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5Ff3XGHdCpc
Name anti-1,4,5,8,8a,10a-hexahydro-1,4:5,8-dimethanophenanthrene-9,9,10,10-tetracarbonitrile
Appearance Yellowish crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H14N4
InChI InChI=1S/C20H14N4/c21-7-19(8-22)17-13-3-1-11(5-13)15(17)16-12-2-4-14(6-12)18(16)20(19,9-23)10-24/h1-4,11-14,17-18H,5-6H2/t11-,12-,13+,14+,17-,18+/m0/s1
InChIKey AYYFWPQVRUSVPZ-QFQJSSFHSA-N
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.5.39
Molecular Weight 310.360 g/mol
SMILES C1=C[C@]2(C[C@@]1([C@]1(C2=C2[C@@]([C@]3(C[C@@]2(C=C3)[H])[H])(C(C1(C#N)C#N)(C#N)C#N)[H])[H])[H])[H]
SPLASH splash10-014l-0591000000-606e51ac7b928345d374
Source of Spectrum BJO-5-5-21
Wiley ID 1871628