Dataset

distortionless enhancement with polarization transfer (DEPT)

dataset for distortionless enhancement with polarization transfer (DEPT)

Chemical Information

molecular Image
InChI InChI=1S/C30H18F15NO2/c1-48-21-15-12-18(13-16-21)11-14-20-9-5-6-10-22(20)46(17-19-7-3-2-4-8-19)23(47)24(31,32)25(33,34)26(35,36)27(37,38)28(39,40)29(41,42)30(43,44)45/h2-10,12-13,15-16H,17H2,1H3
SMILES COc1ccc(cc1)C#Cc1ccccc1N(C(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)Cc1ccccc1
InChI Key GEFBQFBDCKVRHL-UHFFFAOYSA-N
Molecular Formula C30H18F15NO2
Exact Mass 709.445 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/GEFBQFBDCKVRHL-UHFFFAOYSA-N/CHMO0000596
License URL
Source https://www.chemotion-repository.net/inchikey/GEFBQFBDCKVRHL-UHFFFAOYSA-N/CHMO0000596
Version
Author Helena Šimek
Maintainer Chemotion Repository
Language english
MetadataPublished 2022-09-15
Related Molecule
  • N-benzyl-2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluoro-N-[2-[2-(4-methoxyphenyl)ethynyl]phenyl]octanamide
    • Field Value
    Measurement Technique distortionless enhancement with polarization transfer
    Measurement Variables
    Data-Source Molecule ID Data-Source
    164889712 PubChem
    The data in this table is sourced from UniChem at EBI.