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(2E,5E)-4-(4-bromobutyl)-2-(N-methylanilino)hepta-2,5-dienenitrile
SpectraBase Compound ID EaTJe1HimBS
InChI InChI=1S/C18H23BrN2/c1-3-9-16(10-7-8-13-19)14-18(15-20)21(2)17-11-5-4-6-12-17/h3-6,9,11-12,14,16H,7-8,10,13H2,1-2H3/b9-3+,18-14+
InChIKey GKYQNFBNIAIRTJ-KRIWYPROSA-N
Mol Weight 347.3 g/mol
Molecular Formula C18H23BrN2
Exact Mass 346.104462 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9YPFmO48Ata
Name (2E,5E)-4-(4-bromobutyl)-2-(N-methylanilino)hepta-2,5-dienenitrile
Comments Less than 3 mono-isotopic peaks
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Formula C18H23BrN2
InChI InChI=1S/C18H23BrN2/c1-3-9-16(10-7-8-13-19)14-18(15-20)21(2)17-11-5-4-6-12-17/h3-6,9,11-12,14,16H,7-8,10,13H2,1-2H3/b9-3+,18-14+
InChIKey GKYQNFBNIAIRTJ-KRIWYPROSA-N
Molecular Weight 347.300 g/mol
SMILES c1(N(\C(=C\C(\C=C\C)CCCCBr)C#N)C)ccccc1
SPLASH splash10-03di-0094000000-a6dd6337cce6e7b9513b
Source of Spectrum KC-1992-3090-20
Synonyms (E)-8-bromanyl-2-[methyl(phenyl)amino]-4-[(E)-prop-1-enyl]oct-2-enenitrile (E)-8-bromo-2-(N-methylanilino)-4-[(E)-prop-1-enyl]-2-octenenitrile (E)-8-bromo-2-(N-methylanilino)-4-[(E)-prop-1-enyl]oct-2-enenitrile
Wiley ID 777422