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2-t-Butylamino-5,5-dichloro-penta-2,4-dienenitrile
SpectraBase Compound ID Jvpj1InIaRL
InChI InChI=1S/C9H12Cl2N2/c1-9(2,3)13-7(6-12)4-5-8(10)11/h4-5,13H,1-3H3/b7-4+
InChIKey RFABJNMHMSAPGT-QPJJXVBHSA-N
Mol Weight 219.11 g/mol
Molecular Formula C9H12Cl2N2
Exact Mass 218.037754 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A96MA7Vi3XP
Name 2-t-Butylamino-5,5-dichloro-penta-2,4-dienenitrile
Alternate Name(s) (2E)-2-(tert-Butylamino)-5,5-dichloro-2,4-pentadienenitrile
Comments Structure changed after expert review
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Formula C9H12Cl2N2
InChI InChI=1S/C9H12Cl2N2/c1-9(2,3)13-7(6-12)4-5-8(10)11/h4-5,13H,1-3H3/b7-4+
InChIKey RFABJNMHMSAPGT-QPJJXVBHSA-N
Molecular Weight 219.115 g/mol
SMILES N(C(C)(C)C)\C(=C\C=C(Cl)Cl)C#N
SPLASH splash10-0bt9-9510000000-9efb560793d2198a7b1f
Wiley ID 1488228