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4-Methyl-3,5-dioxo-4-azatricyclo[5.5.2.0(2,6)]undec-10-ene-8,9-dicarbonitrile
SpectraBase Compound ID F2qE11p8vuA
InChI InChI=1S/C13H11N3O2/c1-16-12(17)10-6-2-3-7(11(10)13(16)18)9(5-15)8(6)4-14/h2-3,6-11H,1H3/t6-,7+,8-,9-,10?,11?/m0/s1
InChIKey WULYGWDPQWQPRN-ODNVVHBWSA-N
Mol Weight 241.25 g/mol
Molecular Formula C13H11N3O2
Exact Mass 241.085127 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G0ymCHH5ROi
Name 4-Methyl-3,5-dioxo-4-azatricyclo[5.5.2.0(2,6)]undec-10-ene-8,9-dicarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H11N3O2
InChI InChI=1S/C13H11N3O2/c1-16-12(17)10-6-2-3-7(11(10)13(16)18)9(5-15)8(6)4-14/h2-3,6-11H,1H3/t6-,7+,8-,9-,10?,11?/m0/s1
InChIKey WULYGWDPQWQPRN-ODNVVHBWSA-N
Molecular Weight 241.250 g/mol
SMILES C1(N(C(C2[C@]3([C@@]([C@]([C@@](C12)(C=C3)[H])(C#N)[H])(C#N)[H])[H])=O)C)=O
SPLASH splash10-03di-2910000000-f6ef3429968ff9101668
Source of Spectrum H-2005-112-13
Wiley ID 1562105