Hexanoic acid, 5-cyano-5-[(phenylmethylene)amino]-, ethyl ester

SpectraBase Compound ID	3Srl1pUGoJI
InChI	InChI=1S/C16H20N2O2/c1-3-20-15(19)10-7-11-16(2,13-17)18-12-14-8-5-4-6-9-14/h4-6,8-9,12H,3,7,10-11H2,1-2H3/b18-12+
InChIKey	WDEXTEMJBDBOLS-LDADJPATSA-N Google Search
Mol Weight	272.35 g/mol
Molecular Formula	C16H20N2O2
Exact Mass	272.152478 g/mol

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SpectraBase Spectrum ID	DI4GDmMgA6s
Name	Hexanoic acid, 5-cyano-5-[(phenylmethylene)amino]-, ethyl ester
CAS Registry Number	113543-92-3
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C16H20N2O2
InChI	InChI=1S/C16H20N2O2/c1-3-20-15(19)10-7-11-16(2,13-17)18-12-14-8-5-4-6-9-14/h4-6,8-9,12H,3,7,10-11H2,1-2H3/b18-12+
InChIKey	WDEXTEMJBDBOLS-LDADJPATSA-N
Molecular Weight	272.348 g/mol
SMILES	C(#N)C(\N=C\c1ccccc1)(CCCC(=O)OCC)C
SPLASH	splash10-0a4i-0920000000-bde7bc48dc8d8a4e70d4
Source of Spectrum	AJ-60-3356-10
Synonyms	Ethyl 5-benzylideneamino-5-cyanohexanoate Ethyl 5-cyano-5-{[(E)-phenylmethylidene]amino}hexanoate
Wiley ID	1276355