Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR)

Chemical Information

molecular Image
InChI InChI=1S/C36H36O3/c1-22(2)34(37)28-13-7-25(8-14-28)31-19-32(26-9-15-29(16-10-26)35(38)23(3)4)21-33(20-31)27-11-17-30(18-12-27)36(39)24(5)6/h7-24H,1-6H3
SMILES CC(C(=O)c1ccc(cc1)c1cc(cc(c1)c1ccc(cc1)C(=O)C(C)C)c1ccc(cc1)C(=O)C(C)C)C
InChI Key SASADIUGQAVSRR-UHFFFAOYSA-N
Molecular Formula C36H36O3
Exact Mass 516.669 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/SASADIUGQAVSRR-UHFFFAOYSA-N/CHMO0000595
License URL
Source https://www.chemotion-repository.net/inchikey/SASADIUGQAVSRR-UHFFFAOYSA-N/CHMO0000595
Version
Author Isabelle Wessely
Maintainer Chemotion Repository
Language english
MetadataPublished 2020-08-26
Related Molecule
  • 1-[4-[3,5-bis[4-(2-methylpropanoyl)phenyl]phenyl]phenyl]-2-methylpropan-1-one
    • Field Value
    Measurement Technique 13C nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    154573661 PubChem
    The data in this table is sourced from UniChem at EBI.