Dataset

distortionless enhancement with polarization transfer (DEPT)

dataset for distortionless enhancement with polarization transfer (DEPT)

Chemical Information

Molecular Image
InChI InChI=1S/C16H15BrO/c17-15-9-14-8-6-12-3-1-11(2-4-12)5-7-13(15)10-16(14)18/h1-4,9-10,18H,5-8H2
SMILES Oc1cc2CCc3ccc(CCc1cc2Br)cc3
InChI Key CIFGALRTIQKTNB-UHFFFAOYSA-N
Exact Mass 303.194 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/CIFGALRTIQKTNB-UHFFFAOYSA-N/CHMO0000596
License URL
Source https://www.chemotion-repository.net/inchikey/CIFGALRTIQKTNB-UHFFFAOYSA-N/CHMO0000596
Version
Author Stefan Bräse
Maintainer Chemotion Repository
Language english
MetadataPublished 2025-10-27
Related Molecule
Field Value
Measurement Technique CHMO:0000596
Measurement Variables
Date : 2025-08-31

Start time : 22:55:58 UTC

Creator : Adrian Daniel Hund

Label : ADH-85

ID : 382974

Solvent : CDCl3

Temperature : 297.9998 K K

Puls programme : deptsp135

Number of scans : 256

Instrument : Avance NEO

Name : TopSpin

Data-Source Molecule ID Data-Source
6421959 pubchem
The data in this table is sourced from UniChem at EBI.