Dataset

Artemisinin.hsqc

Chemical Info

InChI	InChI=1S/C15H22O5/c1-8-4-5-11-9(2)12(16)17-13-15(11)10(8)6-7-14(3,18-13)19-20-15/h8-11,13H,4-7H2,1-3H3/t8-,9+,10+,11+,13-,14-,15-/m0/s1
SMILES	C[C@H]1CC[C@@H]2[C@@H](C)C(=O)O[C@H]3O[C@]4(C)CC[C@H]1[C@@]32OO4
InChI Key	BLUAFEHZUWYNDE-LJWSOQGGSA-N
Molecular Formula	C15H22O5
Exact Mass	282.330 g/mol

Data and Resources

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Metadata Information

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• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.57992/nmrxiv.p28.s181.d773
License URL	https://creativecommons.org/licenses/by/4.0/legalcode
Source	https://nmrxiv.org/D773
Version
Author	Katrin Eckhardt, Prof. Dr. Klaus-Peter Zeller, Prof. Dr. Hans-Ullrich Siehl, Prof. Dr. Stefan Berger, Prof. Dr. Dieter Sicker
Maintainer
Language	english
MetadataCreated	2024-04-22T15:50:51.306162
MetadataModified	2024-09-23T09:29:47.361236
MetadataPublished	2023-12-21 14:06:49

Field	Value
Measurement Technique	heteronuclear single quantum coherence
Measurement Variables	NMR solvent : CDCl3 acquisition nucleus : ['1H', '13C'] NMR spectrum by dimensionality : 2 NMR probe : 5 mm TBI 1H/13C-BB Z-GRD Z5714/0002 Temperature : 295.6 K magnetic field strength : 16.444844184625595 Tesla number of scans : 16 scans nuclear magnetic resonance pulse sequence : hsqcedetgpsisp Spectral Width : [11.9815247414357, 200] number of data points : 22 points relaxation time measurement : 2 seconds

Data-Source Molecule ID	Data-Source
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