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4,4-Dimethyl-3-oxo-2-[1-phenylmeth-(E)-ylidene]pentanenitrile
SpectraBase Compound ID IxzhSPGFBlf
InChI InChI=1S/C14H15NO/c1-14(2,3)13(16)12(10-15)9-11-7-5-4-6-8-11/h4-9H,1-3H3/b12-9+
InChIKey LCWFGOJVGVBWLE-FMIVXFBMSA-N
Mol Weight 213.28 g/mol
Molecular Formula C14H15NO
Exact Mass 213.115364 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LlNuZRawk3L
Name 4,4-Dimethyl-3-oxo-2-[1-phenylmeth-(E)-ylidene]pentanenitrile
Alternate Name(s) (2E)-4,4-dimethyl-3-oxo-2-(phenylmethylene)pentanenitrile (E)-2-Benzylidene-4,4-dimethyl-3-oxo-pentanenitrile (2E)-2-benzylidene-4,4-dimethyl-3-oxopentanenitrile (2E)-2-benzylidene-4,4-dimethyl-3-oxo-pentanenitrile (2E)-4,4-dimethyl-3-oxidanylidene-2-(phenylmethylidene)pentanenitrile (E)-2-benzylidene-4,4-dimethyl-3-oxopentanenitrile
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Formula C14H15NO
InChI InChI=1S/C14H15NO/c1-14(2,3)13(16)12(10-15)9-11-7-5-4-6-8-11/h4-9H,1-3H3/b12-9+
InChIKey LCWFGOJVGVBWLE-FMIVXFBMSA-N
Molecular Weight 213.280 g/mol
SMILES C(\C(=C\c1ccccc1)C#N)(C(C)(C)C)=O
SPLASH splash10-0a6r-6910000000-b60ea67a20c5329ca9b1
Source of Spectrum F4-41-2369-2e
Wiley ID 1672615