Dataset
distortionless enhancement with polarization transfer (DEPT)
Chemical Info
InChI | InChI=1S/C18H8F17N5O/c19-11(20,5-6-41-10-9-37-38-39-40(9)8-4-2-1-3-7(8)36-10)12(21,22)13(23,24)14(25,26)15(27,28)16(29,30)17(31,32)18(33,34)35/h1-4H,5-6H2 |
---|---|
SMILES | FC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(CCOc1nc2ccccc2n2c1nnn2)F |
InChI Key | GAIYTCZAQRWQIX-UHFFFAOYSA-N |
Molecular Formula | C18H8F17N5O |
Exact Mass | 633.262 g/mol |
Data and Resources
Metadata Information
Field | Value |
---|---|
DOI | 10.14272/GAIYTCZAQRWQIX-UHFFFAOYSA-N/CHMO0000596 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/GAIYTCZAQRWQIX-UHFFFAOYSA-N/CHMO0000596 |
Version | |
Author | Jérôme Klein |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-07T05:50:33.347623 |
MetadataModified | 2024-09-07T21:26:26.154653 |
MetadataPublished | 2022-02-11 |
Field | Value |
---|---|
Measurement Technique | distortionless enhancement with polarization transfer |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
---|---|
162623360 | PubChem |
The data in this table is sourced from UniChem at EBI. |