Dataset
13C nuclear magnetic resonance spectroscopy (13C NMR)
Chemical Info
InChI | InChI=1S/C19H14F13N/c1-9-13(2,3)11-8-10(4-5-12(11)33-9)6-7-14(20,21)15(22,23)16(24,25)17(26,27)18(28,29)19(30,31)32/h4-8H,1-3H3/b7-6+ |
---|---|
SMILES | CC1=Nc2c(C1(C)C)cc(cc2)/C=C/C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F |
InChI Key | LZVFZGBIIFCNHD-VOTSOKGWSA-N |
Molecular Formula | C19H14F13N |
Exact Mass | 503.300 g/mol |
Data and Resources
Metadata Information
Field | Value |
---|---|
DOI | 10.14272/LZVFZGBIIFCNHD-VOTSOKGWSA-N/CHMO0000595 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/LZVFZGBIIFCNHD-VOTSOKGWSA-N/CHMO0000595 |
Version | |
Author | Alex Braun |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-07T01:49:59.399546 |
MetadataModified | 2024-09-07T16:10:48.724799 |
MetadataPublished | 2019-11-06 |
Field | Value |
---|---|
Measurement Technique | 13C nuclear magnetic resonance spectroscopy |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
---|---|
139593338 | PubChem |
The data in this table is sourced from UniChem at EBI. |