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Pentanoic acid, 4-cyano-4-[(phenylmethylene)amino]-, methyl ester
SpectraBase Compound ID 6URRrVlOQLQ
InChI InChI=1S/C14H16N2O2/c1-14(11-15,9-8-13(17)18-2)16-10-12-6-4-3-5-7-12/h3-7,10H,8-9H2,1-2H3/b16-10+
InChIKey VPNDNFGIYIJBMP-MHWRWJLKSA-N
Mol Weight 244.29 g/mol
Molecular Formula C14H16N2O2
Exact Mass 244.121178 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DG8E01yhyQj
Name Pentanoic acid, 4-cyano-4-[(phenylmethylene)amino]-, methyl ester
CAS Registry Number 113543-63-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16N2O2
InChI InChI=1S/C14H16N2O2/c1-14(11-15,9-8-13(17)18-2)16-10-12-6-4-3-5-7-12/h3-7,10H,8-9H2,1-2H3/b16-10+
InChIKey VPNDNFGIYIJBMP-MHWRWJLKSA-N
Molecular Weight 244.294 g/mol
SMILES C(#N)C(\N=C\c1ccccc1)(CCC(=O)OC)C
SPLASH splash10-0a4l-0910000000-bf7dc908f389c65d3044
Source of Spectrum AJ-60-3353-2
Synonyms 4-Benzylideneamino-4-cyanopentanoic acid methyl ester Methyl 4-cyano-4-{[(E)-phenylmethylidene]amino}pentanoate
Wiley ID 1247163