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N-Benzalaniline
SpectraBase Compound ID LgHToZ9MHLh
InChI InChI=1S/C13H11N/c1-3-7-12(8-4-1)11-14-13-9-5-2-6-10-13/h1-11H/b14-11-
InChIKey UVEWQKMPXAHFST-KAMYIIQDSA-N
Mol Weight 181.24 g/mol
Molecular Formula C13H11N
Exact Mass 181.089149 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID COONEVGapyB
Name N-Benzalaniline
CAS Registry Number 538-51-2
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 181.089149358 u
Formula C13H11N
InChI InChI=1S/C13H11N/c1-3-7-12(8-4-1)11-14-13-9-5-2-6-10-13/h1-11H/b14-11-
InChIKey UVEWQKMPXAHFST-KAMYIIQDSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 181.238 g/mol
Nominal Mass 181 u
Quality 857
Retention Index 1660
SMILES C=1(\N=C/C=2C=CC=CC2)C=CC=CC1
SPLASH splash10-001i-1900000000-b5e6b1a47278ee429fcd
Sample Comments cis/trans isomerism uncertain
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N-Benzylideneaniline N,1-Bis(phenyl)methanimine
Technique GC/MS
Wiley ID DD2024_008837