Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR)

Chemical Information

molecular Image
InChI InChI=1S/C19H15F3O/c1-18-15(8-9-17(18)23)13-5-3-2-4-12(13)14-10-11(19(20,21)22)6-7-16(14)18/h2-7,10,15H,8-9H2,1H3/t15-,18+/m1/s1
SMILES O=C1CC[C@H]2[C@@]1(C)c1ccc(cc1-c1c2cccc1)C(F)(F)F
InChI Key HFHXGGGJBDBGIG-QAPCUYQASA-N
Exact Mass 316.317 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/HFHXGGGJBDBGIG-QAPCUYQASA-N/CHMO0000595
License URL
Source https://www.chemotion-repository.net/inchikey/HFHXGGGJBDBGIG-QAPCUYQASA-N/CHMO0000595
Version
Author Thorsten Bach
Maintainer Chemotion Repository
Language english
MetadataPublished 2025-11-24
Related Molecule
Field Value
Measurement Technique 13C nuclear magnetic resonance spectroscopy
Measurement Variables
Data-Source Molecule ID Data-Source
177693412 pubchem
The data in this table is sourced from UniChem at EBI.