Dataset

infrared absorption spectroscopy (IR)

dataset for infrared absorption spectroscopy (IR)

Chemical Information

molecular Image
InChI InChI=1S/C14H18O2Si/c1-17(2,3)11-8-12-4-6-13(7-5-12)14-15-9-10-16-14/h4-7,14H,9-10H2,1-3H3
SMILES C[Si](C#Cc1ccc(cc1)C1OCCO1)(C)C
InChI Key MBCAGEMZHOCCET-UHFFFAOYSA-N
Molecular Formula C14H18O2Si
Exact Mass 246.377 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/MBCAGEMZHOCCET-UHFFFAOYSA-N/CHMO0000630
License URL
Source https://www.chemotion-repository.net/inchikey/MBCAGEMZHOCCET-UHFFFAOYSA-N/CHMO0000630
Version
Author Simone Gräßle
Maintainer Chemotion Repository
Language english
MetadataPublished 2023-02-06
Related Molecule
  • 2-[4-(1,3-dioxolan-2-yl)phenyl]ethynyl-trimethylsilane
    • Field Value
    Measurement Technique infrared absorption spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    57612348 PubChem
    SCHEMBL4018845 SureChEMBL
    ZINC000201335226 ZINC
    J3.062.262F Nikkaji
    The data in this table is sourced from UniChem at EBI.