Molecule

3-hydroxy-2,5-diphenylcyclohexa-2,5-diene-1,4-dione

Chemical Information

Molecular Image

InChI	InChI=1S/C18H12O3/c19-15-11-14(12-7-3-1-4-8-12)17(20)18(21)16(15)13-9-5-2-6-10-13/h1-11,21H
SMILES	O=C1C=C(c2ccccc2)C(=O)C(=C1c1ccccc1)O
InChI Key	GXMJKXBNCXNACS-UHFFFAOYSA-N
Exact Mass	276.286 g/mol

9 Related Dataset(s) ⌄

13C nuclear magnetic resonance spectroscopy (13C NMR)

1H nuclear magnetic resonance spectroscopy (1H NMR)

1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)

1H--13C heteronuclear single quantum coherence (1H-13C HSQC)

1H--1H correlation spectroscopy (1H-1H COSY)

attenuated total reflectance Fourier transform infrared spectroscopy (ATR-FTIR)

high-resolution electrospray ionisation time-of-flight mass spectrometry (HR-ESI-TOF-MS)

nuclear magnetic resonance spectroscopy (NMR)

one-dimensional nuclear Overhauser enhancement spectroscopy (1D NOESY)

Metadata Information

Field	Value
NFDI4Chem Molecule ID	nfdi4chem-mol5875
Source
Alternate Name

Field	Value
No additional information available for this Dataset.

Data-Source Molecule ID	Data-Source
17867067	surechembl
85801055	pubchem
The data in this table is sourced from UniChem at EBI.