Dataset

D-mohammed-25-c13[11]

Chemical Information

molecular Image
InChI InChI=1S/C30H52O/c1-20-21(31)9-10-22-27(20,5)12-11-23-28(22,6)16-18-30(8)24-19-25(2,3)13-14-26(24,4)15-17-29(23,30)7/h20-24,31H,9-19H2,1-8H3
SMILES CC1C(O)CCC2C1(C)CCC1C2(C)CCC2(C)C3CC(C)(C)CCC3(C)CCC12C
InChI Key XCDQFROEGGNAER-UHFFFAOYSA-N

Data and Resources

Metadata Information

Field Value
DOI 10.57992/nmrxiv.p167.s1758.d7754
License URL
Source https://nmrxiv.org/D7754
Version
Author
Maintainer
Language english
MetadataPublished 2026-03-21T17:47:28.000000Z
Related Molecule
Field Value
Measurement Technique 13C nuclear magnetic resonance spectroscopy
Measurement Variables
NMR solvent : CDCl3

acquisition nucleus : ['13C']

NMR spectrum by dimensionality : 1

NMR probe : 5 mm PABBO BB/19F-1H/D Z-GRD Z108618/0665

Temperature : 298.1522 K

magnetic field strength : 9.396259966674501 Tesla

number of scans : 1849 scans

nuclear magnetic resonance pulse sequence : zgpg30

Spectral Width : 238.896696692068

number of data points : 65536 points

relaxation time measurement : 2 seconds

Data-Source Molecule ID Data-Source
27340617 surechembl
348029 pubchem
PD064992 probes_and_drugs
HMDB0251848 hmdb
The data in this table is sourced from UniChem at EBI.