Dataset

distortionless enhancement with polarization transfer (DEPT)

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

Chemical Info

molecular Image
InChI InChI=1S/C11H12O4/c1-7-4-10(14-8(2)12)6-11(5-7)15-9(3)13/h4-6H,1-3H3
SMILES CC(=O)Oc1cc(OC(=O)C)cc(c1)C
InChI Key KDOYCAADBINREP-UHFFFAOYSA-N
Exact Mass 208.211 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/KDOYCAADBINREP-UHFFFAOYSA-N/CHMO0000596.3
License URL
Source https://www.chemotion-repository.net/inchikey/KDOYCAADBINREP-UHFFFAOYSA-N/CHMO0000596.3
Version
Author Simone Gräßle
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-08T02:14:47.789367
MetadataModified 2024-09-23T09:21:44.927201
MetadataPublished 2024-01-19
Field Value
Measurement Technique distortionless enhancement with polarization transfer
Measurement Variables
Temperature : 300.0 K K

Puls programme : deptsp135

Number of scans : 256

Title : SG-V4013(18-26)

Date : 20231104

Start time : 0.44 h

Instrument : spect

Label : SG-3395

ID : 281361

Solvent : chloroform-D1 (CDCl3)

Data-Source Molecule ID Data-Source
SCHEMBL1701666 SureChEMBL
13886888 PubChem
ZINC000014590465 ZINC
The data in this table is sourced from UniChem at EBI.