Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C37H33BrO4Si/c1-36(2,3)43(26-14-6-4-7-15-26,27-16-8-5-9-17-27)42-25-22-23-37(35(41)30-20-12-13-21-32(30)38)31(24-25)33(39)28-18-10-11-19-29(28)34(37)40/h4-22,31H,23-24H2,1-3H3/t31-,37+/m0/s1
SMILES Brc1ccccc1C(=O)[C@]12CC=C(C[C@H]1C(=O)c1c(C2=O)cccc1)O[Si](C(C)(C)C)(c1ccccc1)c1ccccc1
InChI Key FOIXCRBFVLPZHR-DWEWYUIOSA-N
Molecular Formula C37H33BrO4Si
Exact Mass 649.645 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/FOIXCRBFVLPZHR-DWEWYUIOSA-N/CHMO0000593
License URL
Source https://www.chemotion-repository.net/inchikey/FOIXCRBFVLPZHR-DWEWYUIOSA-N/CHMO0000593
Version
Author Janina Beck
Maintainer Chemotion Repository
Language english
MetadataPublished 2020-05-07
Related Molecule
  • (4aR,9aR)-9a-(2-bromobenzoyl)-3-[tert-butyl(diphenyl)silyl]oxy-4,4a-dihydro-1H-anthracene-9,10-dione
    • Field Value
    Measurement Technique 1H nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    146035821 PubChem
    UYUCEZ CCDC
    The data in this table is sourced from UniChem at EBI.