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(2E,5E)-4-(2-bromoethyl)-2-(N-methylanilino)hepta-2,5-dienenitrile
SpectraBase Compound ID 1SZWp7nYt7R
InChI InChI=1S/C16H19BrN2/c1-3-7-14(10-11-17)12-16(13-18)19(2)15-8-5-4-6-9-15/h3-9,12,14H,10-11H2,1-2H3/b7-3+,16-12+
InChIKey PRJHXUFQQLNKOV-WUUILGAPSA-N
Mol Weight 319.25 g/mol
Molecular Formula C16H19BrN2
Exact Mass 318.073162 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LLgW9bPzzZm
Name (2E,5E)-4-(2-bromoethyl)-2-(N-methylanilino)hepta-2,5-dienenitrile
Alternate Name(s) (2E,5E)-4-(2-bromoethyl)-2-[methyl(phenyl)amino]hepta-2,5-dienenitrile
Comments Less than 3 mono-isotopic peaks
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Formula C16H19BrN2
InChI InChI=1S/C16H19BrN2/c1-3-7-14(10-11-17)12-16(13-18)19(2)15-8-5-4-6-9-15/h3-9,12,14H,10-11H2,1-2H3/b7-3+,16-12+
InChIKey PRJHXUFQQLNKOV-WUUILGAPSA-N
Molecular Weight 319.246 g/mol
SMILES c1(N(\C(=C\C(\C=C\C)CCBr)C#N)C)ccccc1
SPLASH splash10-03di-0091000000-223b6b46609d94246f79
Source of Spectrum KC-1992-3090-16
Wiley ID 777167