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2-(2'-Benzyl-3'-(4"-methoxyphenyl)but-2'-enyl)malononitrile
SpectraBase Compound ID 1dsAERHwbwx
InChI InChI=1S/C21H20N2O/c1-16(19-8-10-21(24-2)11-9-19)20(13-18(14-22)15-23)12-17-6-4-3-5-7-17/h3-11,18H,12-13H2,1-2H3/b20-16+
InChIKey CUZJBDYQFGQOGN-CAPFRKAQSA-N
Mol Weight 316.4 g/mol
Molecular Formula C21H20N2O
Exact Mass 316.157563 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CFug1Uyaw86
Name 2-(2'-Benzyl-3'-(4"-methoxyphenyl)but-2'-enyl)malononitrile
Alternate Name(s) 2-[(2Z)-2-benzyl-3-(4-methoxyphenyl)-2-butenyl]malononitrile
Comments Less than 3 mono-isotopic peaks
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Formula C21H20N2O
InChI InChI=1S/C21H20N2O/c1-16(19-8-10-21(24-2)11-9-19)20(13-18(14-22)15-23)12-17-6-4-3-5-7-17/h3-11,18H,12-13H2,1-2H3/b20-16+
InChIKey CUZJBDYQFGQOGN-CAPFRKAQSA-N
Molecular Weight 316.404 g/mol
SMILES c1(\C(=C\(CC(C#N)C#N)Cc2ccccc2)C)ccc(cc1)OC
SPLASH splash10-0006-9002000000-8faf09e4bf000186e209
Source of Spectrum QF-9-6054-5
Wiley ID 1559127