Dataset
12a_JCAMP.
Chemical Info
InChI | InChI=1S/C17H30O3/c1-5-6-7-8-9-10-11-15-14(18)12-13-16(19-15)20-17(2,3)4/h12-13,15-16H,5-11H2,1-4H3 |
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SMILES | [CH:1]1=[CH:2][CH:3]([O:16][C:17]([CH3:18])([CH3:19])[CH3:20])[O:4][CH:5]([CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH3:15])[C:6]1=[O:7] |
InChI Key | BMHCBBLRQFEKMM-UHFFFAOYSA-N |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.57992/nmrxiv.p57.s351.d1885 |
License URL | https://creativecommons.org/licenses/by/4.0/legalcode |
Source | https://nmrxiv.org/D1885 |
Version | |
Author | Toni Ditfe, Dr. Eileen Bette, Dr. Haider N. Sultani, Dr. Alexander Otto, Prof. Dr. Ludger A. Wessjohann, Dr. Norbert Arnold, Prof. Dr. Bernhard Westermann |
Maintainer | |
Language | english |
MetadataCreated | 2024-05-15T09:29:10.536228 |
MetadataModified | 2024-09-23T09:38:10.630862 |
MetadataPublished | 2024-01-19 09:20:10 |
Field | Value |
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Measurement Technique | |
Measurement Variables |
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