NMR Unknown Data Sets

This is a set of spectroscopic data for the identification of unknown compounds. It was prepared for Chemistry 465, Advanced Spectroscopy, at Widener University by S.E. Van Bramer. Use of this data will require several helper applications. Experimental Details are given below.


Data

NMR Unknowns. Solve Using NMR and Elemental Analysis.

Unknown # Elem
Comp
1H NMR FID 13C NMR FID Comments
10 data data data Solve with NMR and elemental analysis
13 data data data Solve with NMR and elemental analysis
14 data data data Solve with NMR and elemental analysis
15 data data data Solve with NMR and elemental analysis
16 data data data Solve with NMR and elemental analysis
17 data data data Solve with NMR and elemental analysis
18 data data data Solve with NMR and elemental analysis
19 data data data Solve with NMR and elemental analysis
20 data data data Solve with NMR and elemental analysis
25 data data data Solve with NMR and elemental analysis
29 data data data Solve with NMR and elemental analysis
30 data data data Solve with NMR and elemental analysis
31 data data data Solve with NMR and elemental analysis
34 data data data Solve with NMR and elemental analysis
35 data data data Solve with NMR and elemental analysis
36 data data data Solve with NMR and elemental analysis


Experimental Details

Elemental Composition

The elemental composition for each sample was calculated from the molecular formula of the sample.

NMR

NMR were aquired using the Widener University QE 300+ FT-NMR. Unless noted all spectra were aquired using CDCl3 with 0.2% TMS for the solvent. FID's were downloaded from the spectrometer and converted into NUTS format. The FID's may be processed using NUTS from Acorn NMR. A demo version is available for processing (but not printing or saving) data.


This page is maintained by
Scott Van Bramer
Department of Chemistry
Widener University
Chester, PA 19013

Please send any comments, corrections, or suggestions to svanbram@science.widener.edu.

This page has been accessed 14681 times since 1/5 /96 .
Last Updated Tuesday, March 12, 2002 9:40:17 AM