Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C14H20BrNSi/c1-14(2,3)17(4,5)16-9-8-11-10-12(15)6-7-13(11)16/h6-10H,1-5H3
SMILES Brc1ccc2c(c1)ccn2[Si](C(C)(C)C)(C)C
InChI Key WBOWSDFSONZNEE-UHFFFAOYSA-N
Exact Mass 310.305 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/WBOWSDFSONZNEE-UHFFFAOYSA-N/CHMO0000595
License URL
Source https://www.chemotion-repository.net/inchikey/WBOWSDFSONZNEE-UHFFFAOYSA-N/CHMO0000595
Version
Author Tilman Hans Köhler
Maintainer Chemotion Repository
Language english
MetadataPublished 2025-02-26
Related Molecule
  • (5-bromoindol-1-yl)-tert-butyl-dimethylsilane
    • Field Value
    Measurement Technique 13C nuclear magnetic resonance spectroscopy
    Measurement Variables
    Title : Nov15-2024

    Date : 20241116

    Start time : 6.38 h

    Label : KT-1221

    ID : 333920

    Solvent : chloroform-D1 (CDCl3)

    Temperature : 298.0 K K

    Puls programme : zgpg30

    Number of scans : 1024

    Instrument : Avance NEO

    Data-Source Molecule ID Data-Source
    16572992 PubChem: Thomson Pharma
    11472373 PubChem
    SCHEMBL444893 SureChEMBL
    J2.516.082G Nikkaji
    DTXSID70467040 EPA CompTox Dashboard
    ZINC000170170604 ZINC
    CB41216268 ChemicalBook
    The data in this table is sourced from UniChem at EBI.