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(E)-2-cyano-1-[5-(4-cyanophenyl)-2-oxapent-4-enyl]naphthalene
SpectraBase Compound ID 57nJubVZORV
InChI InChI=1S/C22H16N2O/c23-14-18-9-7-17(8-10-18)4-3-13-25-16-22-20(15-24)12-11-19-5-1-2-6-21(19)22/h1-12H,13,16H2/b4-3+
InChIKey UICMEPDJEJEOCD-ONEGZZNKSA-N
Mol Weight 324.38 g/mol
Molecular Formula C22H16N2O
Exact Mass 324.126263 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C5T1TsXGLlT
Name (E)-2-cyano-1-[5-(4-cyanophenyl)-2-oxapent-4-enyl]naphthalene
Appearance Pale yellow solid
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Exact Mass 324.126263142 u
Formula C22H16N2O
InChI InChI=1S/C22H16N2O/c23-14-18-9-7-17(8-10-18)4-3-13-25-16-22-20(15-24)12-11-19-5-1-2-6-21(19)22/h1-12H,13,16H2/b4-3+
InChIKey UICMEPDJEJEOCD-ONEGZZNKSA-N
Instrument Name JEOL JMS-700
Ionization Type EI positive ion
Literature Reference DOI 10.1002/ejoc.202201051
Molecular Weight 324.383 g/mol
Quality 73
Reported Formula C22H16N2O
SMILES C=1(C(=CC=C2C=CC=CC12)C#N)COC\C=C\C=1C=CC(=CC1)C#N
SPLASH splash10-014i-0901000000-69f20490d25098c5537d
Source of Spectrum K1-2022-9-(E)-6ae (DOI: 10.1002/ejoc.202201051)
Wiley ID 1898974