Difference between revisions of "Examples"
From NMReDATA
| Line 20: | Line 20: | ||
- no NMR spectra | - no NMR spectra | ||
| − | + coupling network | + | + coupling network tag (NMREDATA_J) |
| − | + very detailed description with assigned couplings | + | + very detailed description of spectra with assigned couplings (optional) |
~ explicit H | ~ explicit H | ||
~ complex | ~ complex | ||
Revision as of 09:31, 20 October 2017
These examples of NMR records and of NMReDATA files may not be totally correct in their format. Please report any problem...
benzopyrene record: link to zenodo upload / direct download of record
+ prototype exemple of record located in a database : ZENODO (free - max 50 GB per user - REST API - DOI provider - versioning) + Bruker NMR spectra are in the Record + correct pointer to the spectra in the NMReDATA file + correct link to the database record (doi and html) in the NMReDATA file - assignment may not be complete (the NMReDATA file was type manually) ~ Implicit H
Set of ethanol NMReDATA files: (link to GitHub folder)
- no NMR spectra + implicit and explicit H ~ simple
Androsten NMReDATA files (link to GitHub folder)
- no NMR spectra + coupling network tag (NMREDATA_J) + very detailed description of spectra with assigned couplings (optional) ~ explicit H ~ complex
