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2-cyano-3-phenethyl-pent-4-enoic acid ethyl ester
SpectraBase Compound ID FLqjjLzzpnj
InChI InChI=1S/C16H19NO2/c1-3-14(15(12-17)16(18)19-4-2)11-10-13-8-6-5-7-9-13/h3,5-9,14-15H,1,4,10-11H2,2H3
InChIKey ZUOXJZBPLWHAAR-UHFFFAOYSA-N
Mol Weight 257.33 g/mol
Molecular Formula C16H19NO2
Exact Mass 257.141579 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DINfqFXrWR1
Name 2-cyano-3-phenethyl-pent-4-enoic acid ethyl ester
Alternate Name(s) 2-cyano-3-(2-phenylethyl)-4-pentenoic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H19NO2
InChI InChI=1S/C16H19NO2/c1-3-14(15(12-17)16(18)19-4-2)11-10-13-8-6-5-7-9-13/h3,5-9,14-15H,1,4,10-11H2,2H3
InChIKey ZUOXJZBPLWHAAR-UHFFFAOYSA-N
Molecular Weight 257.333 g/mol
SMILES C(C(=O)OCC)(C#N)C(C=C)CCc1ccccc1
SPLASH splash10-03di-0190000000-2234b1de538263e011f3
Source of Spectrum SK-28-3889-5
Wiley ID 880278