For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

Ethyl 2-(2-cyanoethyl)-3-oxo-7-phenoxyheptanoate

View entire compound with spectra: 1 MS (GC)

Ethyl 2-(2-cyanoethyl)-3-oxo-7-phenoxyheptanoate
SpectraBase Compound ID E8EyGlDIl18
InChI InChI=1S/C18H23NO4/c1-2-22-18(21)16(11-8-13-19)17(20)12-6-7-14-23-15-9-4-3-5-10-15/h3-5,9-10,16H,2,6-8,11-12,14H2,1H3
InChIKey IRWLPRVDRVSANE-UHFFFAOYSA-N
Mol Weight 317.39 g/mol
Molecular Formula C18H23NO4
Exact Mass 317.162708 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 9FuPhc9egTu
Name Ethyl 2-(2-cyanoethyl)-3-oxo-7-phenoxyheptanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H23NO4
InChI InChI=1S/C18H23NO4/c1-2-22-18(21)16(11-8-13-19)17(20)12-6-7-14-23-15-9-4-3-5-10-15/h3-5,9-10,16H,2,6-8,11-12,14H2,1H3
InChIKey IRWLPRVDRVSANE-UHFFFAOYSA-N
Literature Reference DOI 10.1002/anie.201204469
Molecular Weight 317.385 g/mol
SMILES C(CC(C(C(=O)OCC)CCC#N)=O)CCOc1ccccc1
SPLASH splash10-00di-3690000000-f3cc860545c7c44154cb
Source of Spectrum ACI-51-SM12-S3l
Wiley ID 1780651