Dataset

distortionless enhancement with polarization transfer (DEPT)

dataset for distortionless enhancement with polarization transfer (DEPT)\n\n

Chemical Info

molecular Image
InChI InChI=1S/C8H7IO3/c1-11-9-7-5-3-2-4-6(7)8(10)12-9/h2-5H,1H3
SMILES CO[I]1OC(=O)c2c1cccc2
InChI Key LUERUKOXOOMVNM-UHFFFAOYSA-N
Exact Mass 278.044 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/LUERUKOXOOMVNM-UHFFFAOYSA-N/CHMO0000596
License URL
Source https://www.chemotion-repository.net/inchikey/LUERUKOXOOMVNM-UHFFFAOYSA-N/CHMO0000596
Version
Author Tilman Hans Köhler
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-08T03:37:33.270010
MetadataModified 2024-09-23T09:24:04.844658
MetadataPublished 2024-05-21
Field Value
Measurement Technique distortionless enhancement with polarization transfer
Measurement Variables
Temperature : 298.0 K K

Puls programme : deptsp90

Number of scans : 256

Title : Jan19-2024

Date : 20240121

Start time : 2.56 h

Instrument : Avance NEO

Label : KT-667

ID : 291534

Solvent : chloroform-D1 (CDCl3)

Data-Source Molecule ID Data-Source
36096094 eMolecules
13741469 PubChem
SCHEMBL12211388 SureChEMBL
J2.478.627G Nikkaji
MXBIOX CCDC
The data in this table is sourced from UniChem at EBI.