Dataset

distortionless enhancement with polarization transfer (DEPT)

dataset for distortionless enhancement with polarization transfer (DEPT)

Chemical Information

molecular Image
InChI InChI=1S/C27H20F15NO/c1-2-3-4-8-13-18-14-9-10-15-19(18)43(16-17-11-6-5-7-12-17)20(44)21(28,29)22(30,31)23(32,33)24(34,35)25(36,37)26(38,39)27(40,41)42/h5-7,9-12,14-15H,2-4,16H2,1H3
SMILES CCCCC#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 KSXCBKGDAXBVCF-UHFFFAOYSA-N
Molecular Formula C27H20F15NO
Exact Mass 659.430 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/KSXCBKGDAXBVCF-UHFFFAOYSA-N/CHMO0000596
License URL
Source https://www.chemotion-repository.net/inchikey/KSXCBKGDAXBVCF-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-hex-1-ynylphenyl)octanamide
    • Field Value
    Measurement Technique distortionless enhancement with polarization transfer
    Measurement Variables
    Data-Source Molecule ID Data-Source
    164889693 PubChem
    The data in this table is sourced from UniChem at EBI.