Dataset

2,3-Dehydrovirgiboidine (14)[15]

Chemical Information

InChI	InChI=1S/C15H22N2O/c1-2-3-7-16-10-12-9-13(11-16)15(18)17-8-5-4-6-14(12)17/h2,5,8,12-14H,1,3-4,6-7,9-11H2/t12-,13+,14+/m0/s1
SMILES	C=CCCN1C[C@H]2C[C@@H](C1)[C@H]1CCC=CN1C2=O
InChI Key	QNUXFFUMUMONPT-BFHYXJOUSA-N

Data and Resources

• 2,3-Dehydrovirgiboidine (14)[15]HTML
  Go to source

Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.57992/nmrxiv.p124.s1262.d5436
License URL	https://creativecommons.org/licenses/by/4.0/legalcode
Source	https://nmrxiv.org/D5436
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	aptjmod
Measurement Variables	NMR solvent : MeOD acquisition nucleus : ['13C'] NMR spectrum by dimensionality : 1 NMR probe : 5 mm CPPBBO BB-1H/19F/D Z-GRD Z122624/0017 Temperature : 292.9988 K magnetic field strength : 11.743848641495527 Tesla number of scans : 256 scans nuclear magnetic resonance pulse sequence : jmod Spectral Width : 236.63686534107 number of data points : 44 points relaxation time measurement : 2 seconds

Data-Source Molecule ID	Data-Source
ZINC000263637956	ZINC
The data in this table is sourced from UniChem at EBI.