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Benzeneacetonitrile, .alpha.-(3-oxobutyl)-.alpha.-(propylideneamino)-
SpectraBase Compound ID 4sXznTecCeO
InChI InChI=1S/C15H18N2O/c1-3-11-17-15(12-16,10-9-13(2)18)14-7-5-4-6-8-14/h4-8,11H,3,9-10H2,1-2H3/b17-11-
InChIKey WGFDYIZYWAEMEA-BOPFTXTBSA-N
Mol Weight 242.32 g/mol
Molecular Formula C15H18N2O
Exact Mass 242.141913 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7cYrkI8hZE7
Name Benzeneacetonitrile, .alpha.-(3-oxobutyl)-.alpha.-(propylideneamino)-
CAS Registry Number 113543-70-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18N2O
InChI InChI=1S/C15H18N2O/c1-3-11-17-15(12-16,10-9-13(2)18)14-7-5-4-6-8-14/h4-8,11H,3,9-10H2,1-2H3/b17-11-
InChIKey WGFDYIZYWAEMEA-BOPFTXTBSA-N
Molecular Weight 242.322 g/mol
SMILES C(C#N)(\N=C/CC)(CCC(=O)C)c1ccccc1
SPLASH splash10-000f-2910000000-f45fd53e93b47c7695ee
Source of Spectrum AJ-60-3354-2
Synonyms 2-Propylideneamino-2-phenyl-5-oxohexanenitrile 5-Oxo-2-phenyl-2-[(Z)-propylideneamino]hexanenitrile
Wiley ID 1245381