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2,3-Dicyano-5-methyl-7-[2-(2-thienyl)ethenyl]-6H-1,4-diazepine
SpectraBase Compound ID AoI5oUnb5nH
InChI InChI=1S/C14H10N4S/c1-10-7-11(4-5-12-3-2-6-19-12)18-14(9-16)13(8-15)17-10/h2-6H,7H2,1H3/b5-4+
InChIKey ADYGDTXDORWRGN-SNAWJCMRSA-N
Mol Weight 266.32 g/mol
Molecular Formula C14H10N4S
Exact Mass 266.062618 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4SwZmJlNLiM
Name 2,3-Dicyano-5-methyl-7-[2-(2-thienyl)ethenyl]-6H-1,4-diazepine
Alternate Name(s) 5-Methyl-7-[(E)-2-(2-thienyl)ethenyl]-6H-1,4-diazepine-2,3-dicarbonitrile
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Formula C14H10N4S
InChI InChI=1S/C14H10N4S/c1-10-7-11(4-5-12-3-2-6-19-12)18-14(9-16)13(8-15)17-10/h2-6H,7H2,1H3/b5-4+
InChIKey ADYGDTXDORWRGN-SNAWJCMRSA-N
Molecular Weight 266.322 g/mol
SMILES C=1(N=C(CC(=NC1C#N)C)\C=C\c1cccs1)C#N
SPLASH splash10-014i-1190000000-a2d749430b48f542e5ae
Source of Spectrum HC-78-321-19
Wiley ID 1612691