Dataset
MS_87_700MHz.hsqc
Chemical Info
InChI | InChI=1S/C25H24FNO/c1-18-13-14-22(20-10-4-3-9-19(18)20)25(28)23-17-27(16-8-2-7-15-26)24-12-6-5-11-21(23)24/h3-6,9-14,17H,2,7-8,15-16H2,1H3 |
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SMILES | CC1=CC=C(C(=O)C2=CN(CCCCCF)C3=CC=CC=C23)C2=C1C=CC=C2 |
InChI Key | IGBHZHCGWLHBAE-UHFFFAOYSA-N |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.57992/nmrxiv.p84.s717.d3534 |
License URL | https://creativecommons.org/licenses/by-nc-nd/4.0/legalcode |
Source | https://nmrxiv.org/D3534 |
Version | |
Author | Eva‐Maria Hubner, Martin G. Schmid, Verina Manojlovic, Daniela Gattringer, Eva‐Maria Pferschy‐Wenzig, Olaf Kunert |
Maintainer | |
Language | english |
MetadataCreated | 2025-02-03T16:50:31.742894 |
MetadataModified | 2025-02-03T16:50:31.742900 |
MetadataPublished | 2025-01-09 07:49:00 |
Related Molecule |