Molecule

2-(3,4-dimethoxyphenyl)-1,3-dithiolane

Chemical Information

Molecular Image

InChI	InChI=1S/C11H14O2S2/c1-12-9-4-3-8(7-10(9)13-2)11-14-5-6-15-11/h3-4,7,11H,5-6H2,1-2H3
SMILES	COc1cc(ccc1OC)C1SCCS1
InChI Key	GCEOBMQOSMEWSN-UHFFFAOYSA-N
Exact Mass	242.358 g/mol

7 Related Dataset(s) ⌄

13C nuclear magnetic resonance spectroscopy (13C NMR)

1H nuclear magnetic resonance spectroscopy (1H NMR)

distortionless enhancement with polarization transfer (DEPT)

distortionless enhancement with polarization transfer (DEPT)

electron ionisation mass spectrometry (EI-MS)

elemental analysis (EA)

infrared absorption spectroscopy (IR)

Metadata Information

Field	Value
NFDI4Chem Molecule ID	nfdi4chem-mol3801
Source
Alternate Name

Field	Value
No additional information available for this Dataset.

Data-Source Molecule ID	Data-Source
9778828	surechembl
50928	pubchem
DTXSID00220201	comptox
The data in this table is sourced from UniChem at EBI.