Dataset

Chamazulene[6]

This dataset contains NMR spectra obtained for the sample containing Chamazulene

Chemical Information

molecular Image

InChI	InChI=1S/C14H16/c1-4-12-7-5-10(2)13-8-6-11(3)14(13)9-12/h5-9H,4H2,1-3H3
SMILES	CCC1=CC2=C(C)C=CC2=C(C)C=C1
InChI Key	GXGJIOMUZAGVEH-UHFFFAOYSA-N
Molecular Formula	C14H16
Exact Mass	184.280 g/mol

Data and Resources

Chamazulene[6]HTML

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Metadata Information

Field	Value
DOI	10.57992/nmrxiv.p42.s1312.d5766
License URL	https://creativecommons.org/licenses/by/4.0/legalcode
Source	https://nmrxiv.org/D5766
Version
Author	Peter Spiteller
Maintainer
Language	english
MetadataPublished	2025-08-31T17:42:30.000000Z
Related Molecule

Field	Value
Measurement Technique
Measurement Variables	NMR solvent : acquisition nucleus : NMR spectrum by dimensionality : NMR probe : Temperature : K magnetic field strength : Tesla number of scans : scans nuclear magnetic resonance pulse sequence : Spectral Width : number of data points : points relaxation time measurement : seconds

Data-Source Molecule ID	Data-Source
DB15931	drugbank
CHEBI:3573	chebi
LMPR0103410002	lipidmaps
CHEMBL495665	chembl
180449	surechembl
29562128	surechembl
10719	pubchem
PD143830	probes_and_drugs
Z439UH6E5F	fdasrs
HMDB0036470	hmdb
Molport-006-111-634	molport
The data in this table is sourced from UniChem at EBI.