Dataset

9a and 9b[4 COSY]

Chemical Information

InChI	InChI=1S/2C29H44O4/c2*1-23(2)17-10-14-26(6)19(25(17,5)13-12-21(23)30)8-9-20-27(26,7)16-22-28(31-22)15-11-18-24(3,4)32-33-29(18,20)28/h2*17-20,22H,8-16H2,1-7H3/t17-,18-,19+,20-,22+,25-,26+,27+,28+,29-;17-,18-,19+,20-,22-,25-,26+,27+,28-,29-/m00/s1
SMILES	CC1(C)OO[C@@]23[C@H]4CC[C@@H]5[C@@]6(C)CCC(=O)C(C)(C)[C@@H]6CC[C@@]5(C)[C@]4(C)C[C@@H]4O[C@@]42CC[C@@H]13.CC1(C)OO[C@@]23[C@H]4CC[C@@H]5[C@@]6(C)CCC(=O)C(C)(C)[C@@H]6CC[C@@]5(C)[C@]4(C)C[C@H]4O[C@]42CC[C@@H]13
InChI Key	MCJKUDFMFXTESI-GCECAIHYSA-N

Data and Resources

• 9a and 9b[4 COSY]HTML
  Go to source

• correlation-spectro...

Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.57992/nmrxiv.p150.s1506.d6626
License URL	https://creativecommons.org/licenses/by-nc/4.0/legalcode
Source	https://nmrxiv.org/D6626
Version
Author
Maintainer
Language	english
MetadataPublished	2025-11-20T10:19:11.000000Z
Related Molecule

Field	Value
Measurement Technique	correlation spectroscopy
Measurement Variables	NMR solvent : CDCl3 acquisition nucleus : ['1H', '1H'] NMR spectrum by dimensionality : 2 NMR probe : Z108618_0647 (PA BBO 400S1 BBF-H-D-05 Z) Temperature : 297.5863 K magnetic field strength : 9.397691291560301 Tesla number of scans : 10 scans nuclear magnetic resonance pulse sequence : cosygpmfqf Spectral Width : [6.54237159767954, 6.54237159767954] number of data points : [2048, 128] points relaxation time measurement : 1.10585 seconds

Data-Source Molecule ID	Data-Source
No additional information available for this Dataset.