Dataset

MS-389.cosy

Chemical Info

molecular Image
InChI InChI=1S/C20H19FINO/c21-12-6-1-7-13-23-14-17(15-8-3-5-11-19(15)23)20(24)16-9-2-4-10-18(16)22/h2-5,8-11,14H,1,6-7,12-13H2
SMILES O=C(C1=CC=CC=C1I)C1=CN(CCCCCF)C2=CC=CC=C12
InChI Key LFFIIZFINPPEMC-UHFFFAOYSA-N

Data and Resources

Metadata Information

Field Value
DOI 10.57992/nmrxiv.p84.s725.d3575
License URL https://creativecommons.org/licenses/by-nc-nd/4.0/legalcode
Source https://nmrxiv.org/D3575
Version
Author Eva‐Maria Hubner, Martin G. Schmid, Verina Manojlovic, Daniela Gattringer, Eva‐Maria Pferschy‐Wenzig, Olaf Kunert
Maintainer
Language english
MetadataCreated 2025-02-03T17:05:35.659693
MetadataModified 2025-02-03T17:05:35.659699
MetadataPublished 2025-01-09 07:49:00
Related Molecule