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Quinolinium, 1-cyano-2-oxo-2-phenylethylide
SpectraBase Compound ID 5rLT0lHLeTE
InChI InChI=1S/C18H12N2O/c19-11-16(18(21)13-6-2-1-3-7-13)15-10-14-8-4-5-9-17(14)20-12-15/h1-10,12,21H/b18-16-
InChIKey AHVROROHWIIAKR-VLGSPTGOSA-N
Mol Weight 272.31 g/mol
Molecular Formula C18H12N2O
Exact Mass 272.094963 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7USKXC0zWIN
Name Quinolinium, 1-cyano-2-oxo-2-phenylethylide
Alternate Name(s) (2E)-3-hydroxy-3-phenyl-2-(3-quinolinyl)-2-propenenitrile .alpha.-cyanoquinoliniumphenacylide 1-Cyano-2-hydroxy-2-phenyl-1-(3-quinolyl)ethylene
CAS Registry Number 61095-43-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H12N2O
InChI InChI=1S/C18H12N2O/c19-11-16(18(21)13-6-2-1-3-7-13)15-10-14-8-4-5-9-17(14)20-12-15/h1-10,12,21H/b18-16-
InChIKey AHVROROHWIIAKR-VLGSPTGOSA-N
Molecular Weight 272.307 g/mol
SMILES O\C(=C/(c1cc2ccccc2nc1)C#N)c1ccccc1
SPLASH splash10-0a4i-3920000000-6078a412a08b9b6f922f
Source of Spectrum C-98-5676-0
Wiley ID 1276531