Dataset

2-exo-2-Methoxyvirgiboidine (18)[16]

Chemical Information

molecular Image
InChI InChI=1S/C16H26N2O2/c1-3-4-8-17-10-12-9-13(11-17)16(19)18-14(12)6-5-7-15(18)20-2/h3,12-15H,1,4-11H2,2H3/t12-,13+,14+,15-/m0/s1
SMILES C=CCCN1C[C@H]2C[C@@H](C1)[C@H]1CCC[C@H](OC)N1C2=O
InChI Key MUPBYAPLMBRUCR-YJNKXOJESA-N

Data and Resources

Metadata Information

Field Value
DOI 10.57992/nmrxiv.p124.s1256.d5402
License URL https://creativecommons.org/licenses/by/4.0/legalcode
Source https://nmrxiv.org/D5402
Version
Author Arses K.; Gibbons W. A.; Phillipson J. D.; Mascagni P.
Maintainer
Language english
MetadataPublished 2025-08-18T08:13:00.000000Z
Related Molecule
Field Value
Measurement Technique noesy
Measurement Variables
NMR solvent : CDCl3

acquisition nucleus : ['1H', '1H']

NMR spectrum by dimensionality : 2

NMR probe : 5 mm CPPBBO BB-1H/19F/D Z-GRD Z122624/0017

Temperature : 293.0005 K

magnetic field strength : 11.746350827011339 Tesla

number of scans : 64 scans

nuclear magnetic resonance pulse sequence : noesygpphpp

Spectral Width : [7.46071625977054, 7.46071625977054]

number of data points : 16 points

relaxation time measurement : 1.930368 seconds

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