Dataset

15[1 H]

Chemical Information

molecular Image
InChI InChI=1S/C29H46O4/c1-24(2)19-11-15-27(6)20(26(19,5)13-12-23(24)31)8-9-21-28(27,7)14-10-17-18(30)16-22(25(3,4)32)29(17,21)33/h17,19-22,32-33H,8-16H2,1-7H3/t17-,19+,20-,21+,22+,26+,27-,28-,29-/m1/s1
SMILES CC(C)(O)[C@@H]1CC(=O)[C@H]2CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)[C@@H]5CC[C@]43C)[C@]21O
InChI Key ZXQXTNOOBXFNSJ-BZPWSALFSA-N

Data and Resources

Metadata Information

Field Value
DOI 10.57992/nmrxiv.p150.s1505.d6616
License URL https://creativecommons.org/licenses/by-nc/4.0/legalcode
Source https://nmrxiv.org/D6616
Version
Author
Maintainer
Language english
MetadataPublished 2025-11-20T10:19:11.000000Z
Related Molecule
Field Value
Measurement Technique 1H nuclear magnetic resonance spectroscopy
Measurement Variables
NMR solvent : CDCl3

acquisition nucleus : ['1H']

NMR spectrum by dimensionality : 1

NMR probe : Z108618_0647 (PA BBO 400S1 BBF-H-D-05 Z)

Temperature : 298.4304 K

magnetic field strength : 9.397691291560301 Tesla

number of scans : 32 scans

nuclear magnetic resonance pulse sequence : zg30

Spectral Width : 16.978067386969

number of data points : 27172 points

relaxation time measurement : 2 seconds

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