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

*Links on SpectraBase are not permalinks.
n-Butyl 5-oxo-4-phenyl-5-(2'-pyridyl) pentanoate
SpectraBase Compound ID CzgEkbGJlyX
InChI InChI=1S/C20H23NO3/c1-2-3-15-24-19(22)13-12-17(16-9-5-4-6-10-16)20(23)18-11-7-8-14-21-18/h4-11,14,17H,2-3,12-13,15H2,1H3
InChIKey CGXDMBVORMKGSW-UHFFFAOYSA-N
Mol Weight 325.41 g/mol
Molecular Formula C20H23NO3
Exact Mass 325.167794 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 CDFTbLD5Wcu
Name n-Butyl 5-oxo-4-phenyl-5-(2'-pyridyl) pentanoate
Alternate Name(s) Butyl 5-oxo-4-phenyl-5-(pyridin-2-yl)pentanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H23NO3
InChI InChI=1S/C20H23NO3/c1-2-3-15-24-19(22)13-12-17(16-9-5-4-6-10-16)20(23)18-11-7-8-14-21-18/h4-11,14,17H,2-3,12-13,15H2,1H3
InChIKey CGXDMBVORMKGSW-UHFFFAOYSA-N
Literature Reference DOI 10.1039/c4cc00931b
Molecular Weight 325.408 g/mol
SMILES c1cc(C(C(c2ccccc2)CCC(=O)OCCCC)=O)ncc1
SPLASH splash10-02di-8951000000-ffda87d7208e829887b2
Source of Spectrum KD-50-5970/SMS8-3c
Wiley ID 1754492