Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR)\n\n

Chemical Info

molecular Image
InChI InChI=1S/C18H12O4/c19-13-8-6-11(7-9-13)14-10-15(20)16(18(22)17(14)21)12-4-2-1-3-5-12/h1-10,19,22H
SMILES Oc1ccc(cc1)C1=CC(=O)C(=C(C1=O)O)c1ccccc1
InChI Key HLFCRNGNTFLPPX-UHFFFAOYSA-N
Molecular Formula C18H12O4
Exact Mass 292.285 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/HLFCRNGNTFLPPX-UHFFFAOYSA-N/CHMO0000593
License URL
Source https://www.chemotion-repository.net/inchikey/HLFCRNGNTFLPPX-UHFFFAOYSA-N/CHMO0000593
Version
Author Anja Schueffler
Maintainer Chemotion Repository
Language english
MetadataCreated 2025-04-06T02:00:54.074628
MetadataModified 2025-04-06T02:15:56.174795
MetadataPublished 2025-04-03
Related Molecule