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Glycine, N-[-4,4-dicyano-1,3-butadien-1-yl]-N-[2-oxo-2-(phenylmethoxy)ethyl]-, phenylmethyl ester
SpectraBase Compound ID 1bs3OC8W6f2
InChI InChI=1S/C24H21N3O4/c25-14-22(15-26)12-7-13-27(16-23(28)30-18-20-8-3-1-4-9-20)17-24(29)31-19-21-10-5-2-6-11-21/h1-13H,16-19H2/b13-7+
InChIKey CLHRUDRSCJSTEJ-NTUHNPAUSA-N
Mol Weight 415.45 g/mol
Molecular Formula C24H21N3O4
Exact Mass 415.153206 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5eVPSKrQmlr
Name Glycine, N-[-4,4-dicyano-1,3-butadien-1-yl]-N-[2-oxo-2-(phenylmethoxy)ethyl]-, phenylmethyl ester
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Formula C24H21N3O4
InChI InChI=1S/C24H21N3O4/c25-14-22(15-26)12-7-13-27(16-23(28)30-18-20-8-3-1-4-9-20)17-24(29)31-19-21-10-5-2-6-11-21/h1-13H,16-19H2/b13-7+
InChIKey CLHRUDRSCJSTEJ-NTUHNPAUSA-N
Molecular Weight 415.449 g/mol
SMILES c1(COC(CN(CC(=O)OCc2ccccc2)\C=C\C=C(C#N)C#N)=O)ccccc1
SPLASH splash10-0a4i-6900000000-ad5b669108f072d800e3
Source of Spectrum JX-2015-4-213
Synonyms dibenzyl 2,2'-((4,4-dicyanobuta-1,3-dien-1-yl)azanediyl)diacetate 2-[[4,4-dicyanobuta-1,3-dienyl]-(2-oxo-2-phenylmethoxyethyl)amino]acetic acid (phenylmethyl) ester Benzyl 2-[[4,4-dicyanobuta-1,3-dienyl]-(2-oxo-2-phenylmethoxyethyl)amino]acetate Benzyl 2-[(2-benzyloxy-2-oxo-ethyl)-[4,4-dicyanobuta-1,3-dienyl]amino]acetate (phenylmethyl) 2-[[4,4-dicyanobuta-1,3-dienyl]-(2-oxidanylidene-2-phenylmethoxy-ethyl)amino]ethanoate
Wiley ID 1725662