Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C8H14O3S2Si/c1-11-13(9,10)7-5-6-8(12-7)14(2,3)4/h5-6H,1-4H3
SMILES COS(=O)(=O)c1ccc(s1)[Si](C)(C)C
InChI Key BCYPIVOWPZWHJT-UHFFFAOYSA-N
Exact Mass 250.410 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/BCYPIVOWPZWHJT-UHFFFAOYSA-N/CHMO0000595
License URL
Source https://www.chemotion-repository.net/inchikey/BCYPIVOWPZWHJT-UHFFFAOYSA-N/CHMO0000595
Version
Author Georg Manolikakes
Maintainer Chemotion Repository
Language english
MetadataPublished 2025-12-17
Related Molecule
Field Value
Measurement Technique 13C nuclear magnetic resonance spectroscopy
Measurement Variables
Date : 2024-12-13

Start time : 14:45:19 UTC

Creator : Po-Chung Chien

Label : PCC-932

ID : 148180

Solvent : CDCl3

Temperature : 296.701 K K

Puls programme : zgpg30

Number of scans : 512

Instrument : spect

Name : Parameter file, TOPSPIN Version 3.0

Version : Parameter file, TOPSPIN Version 3.0

Data-Source Molecule ID Data-Source
177807918 pubchem
The data in this table is sourced from UniChem at EBI.