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(3a.alpha.,4.alpha.,7.alpha.,7a.alpha.)-8,8,9,9-Tetracyano-3a,4,7,7a-tetrahydro-2,2-dimethyl-4,7-ethano-1,3-benzodioxole
SpectraBase Compound ID 9Szx1GBR7sQ
InChI InChI=1S/C15H12N4O2/c1-13(2)20-11-9-3-4-10(12(11)21-13)15(7-18,8-19)14(9,5-16)6-17/h3-4,9-12H,1-2H3/t9-,10+,11-,12+
InChIKey QVYMIPVQMBAXNU-BKUVIOGVSA-N
Mol Weight 280.29 g/mol
Molecular Formula C15H12N4O2
Exact Mass 280.096026 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KNXqj7BLWV8
Name (3a.alpha.,4.alpha.,7.alpha.,7a.alpha.)-8,8,9,9-Tetracyano-3a,4,7,7a-tetrahydro-2,2-dimethyl-4,7-ethano-1,3-benzodioxole
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Formula C15H12N4O2
InChI InChI=1S/C15H12N4O2/c1-13(2)20-11-9-3-4-10(12(11)21-13)15(7-18,8-19)14(9,5-16)6-17/h3-4,9-12H,1-2H3/t9-,10+,11-,12+
InChIKey QVYMIPVQMBAXNU-BKUVIOGVSA-N
Molecular Weight 280.287 g/mol
SMILES C1(C([C@]2([H])[C@]3([C@@]([C@]1(C=C2)[H])(OC(C)(C)O3)[H])[H])(C#N)C#N)(C#N)C#N
SPLASH splash10-052g-9010000000-3b0d97638466940565b4
Source of Spectrum F5-4-3845-31
Synonyms (3aR,4S,7R,7aS)-2,2-dimethyl-3a,4,7,7a-tetrahydro-4,7-ethanobenzo[d][1,3]dioxole-8,8,9,9-tetracarbonitrile
Wiley ID 1733043