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2-(cyanomethyl)-2-phenyl-malonic acid diethyl ester
SpectraBase Compound ID 6sj3toyc8l2
InChI InChI=1S/C15H17NO4/c1-3-19-13(17)15(10-11-16,14(18)20-4-2)12-8-6-5-7-9-12/h5-9H,3-4,10H2,1-2H3
InChIKey YPQUPBBEDDHCNC-UHFFFAOYSA-N
Mol Weight 275.3 g/mol
Molecular Formula C15H17NO4
Exact Mass 275.115758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DOREoV8noy7
Name 2-(cyanomethyl)-2-phenyl-malonic acid diethyl ester
Alternate Name(s) 2-(cyanomethyl)-2-phenylpropanedioic acid diethyl ester Diethyl 2-(cyanomethyl)-2-phenyl-propanedioate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H17NO4
InChI InChI=1S/C15H17NO4/c1-3-19-13(17)15(10-11-16,14(18)20-4-2)12-8-6-5-7-9-12/h5-9H,3-4,10H2,1-2H3
InChIKey YPQUPBBEDDHCNC-UHFFFAOYSA-N
Molecular Weight 275.304 g/mol
SMILES C(C(=O)OCC)(C(=O)OCC)(c1ccccc1)CC#N
SPLASH splash10-0fb9-1920000000-1d8a2a786fa540db0c3c
Source of Spectrum JA-50-813-0
Wiley ID 1279089