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Benzenehexanoic acid, .delta.-cyano-.delta.-[(phenylmethylene)amino]-, ethyl ester
SpectraBase Compound ID LNPJpO1q6mQ
InChI InChI=1S/C22H24N2O2/c1-2-26-21(25)14-9-15-22(18-23,16-19-10-5-3-6-11-19)24-17-20-12-7-4-8-13-20/h3-8,10-13,17H,2,9,14-16H2,1H3/b24-17+
InChIKey MMLWENSVBUBJQW-JJIBRWJFSA-N
Mol Weight 348.45 g/mol
Molecular Formula C22H24N2O2
Exact Mass 348.183778 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LwlKgRIjeIc
Name Benzenehexanoic acid, .delta.-cyano-.delta.-[(phenylmethylene)amino]-, ethyl ester
CAS Registry Number 113543-93-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H24N2O2
InChI InChI=1S/C22H24N2O2/c1-2-26-21(25)14-9-15-22(18-23,16-19-10-5-3-6-11-19)24-17-20-12-7-4-8-13-20/h3-8,10-13,17H,2,9,14-16H2,1H3/b24-17+
InChIKey MMLWENSVBUBJQW-JJIBRWJFSA-N
Molecular Weight 348.446 g/mol
SMILES C(#N)C(\N=C\c1ccccc1)(Cc1ccccc1)CCCC(=O)OCC
SPLASH splash10-000x-9450000000-99ed89dbaf77db7fb4da
Source of Spectrum AJ-60-3356-10
Synonyms Ethyl 5-benzylideneamino-5-cyano-6-phenylhexanoate Ethyl 5-cyano-6-phenyl-5-{[(E)-phenylmethylidene]amino}hexanoate
Wiley ID 1340964