Dataset
MS-364-neu.cosy
Chemical Info
InChI | InChI=1S/C20H27FN2O3/c1-20(2,3)17(19(25)26-4)22-18(24)15-13-23(12-8-7-11-21)16-10-6-5-9-14(15)16/h5-6,9-10,13,17H,7-8,11-12H2,1-4H3,(H,22,24) |
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SMILES | COC(=O)C(NC(=O)C1=CN(CCCCF)C2=CC=CC=C12)C(C)(C)C |
InChI Key | QIKHYQCWGUGFBB-UHFFFAOYSA-N |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.57992/nmrxiv.p84.s707.d3481 |
License URL | https://creativecommons.org/licenses/by-nc-nd/4.0/legalcode |
Source | https://nmrxiv.org/D3481 |
Version | |
Author | Eva‐Maria Hubner, Martin G. Schmid, Verina Manojlovic, Daniela Gattringer, Eva‐Maria Pferschy‐Wenzig, Olaf Kunert |
Maintainer | |
Language | english |
MetadataCreated | 2025-02-03T17:04:37.709904 |
MetadataModified | 2025-02-03T17:04:37.709910 |
MetadataPublished | 2025-01-09 07:49:00 |
Related Molecule |