19F nuclear magnetic resonance spectroscopy (19F NMR)
URL: https://www.chemotion-repository.net/inchikey/QCGQHEFTBLBCCJ-JLXBFWJWSA-N/CHMO0000597.1
Dataset description:
dataset for 19F nuclear magnetic resonance spectroscopy (19F NMR)\n\n
Source: 19F nuclear magnetic resonance spectroscopy (19F NMR)
Chemical Info
| InChI | InChI=1S/C39H23F17N6O/c1-20-21(58-23-9-3-2-8-22(23)57-20)14-15-28-29(60-25-11-5-4-10-24(25)59-28)16-17-30-31(62-27-13-7-6-12-26(27)61-30)63-19-18-32(40,41)33(42,43)34(44,45)35(46,47)36(48,49)37(50,51)38(52,53)39(54,55)56/h2-17H,18-19H2,1H3/b15-14+,17-16+ |
|---|---|
| SMILES | Cc1nc2ccccc2nc1/C=C/c1nc2ccccc2nc1/C=C/c1nc2ccccc2nc1OCCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F |
| InChI Key | QCGQHEFTBLBCCJ-JLXBFWJWSA-N |
| Molecular Formula | C39H23F17N6O |
| Exact Mass | 914.612 g/mol |
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Additional Information
| Field | Value |
|---|---|
| Data last updated | September 8, 2024 |
| Metadata last updated | September 8, 2024 |
| Created | September 8, 2024 |
| Format | HTML |
| License | No License Provided |
| Id | 699ba56b-2d2d-478e-bd2b-e5b9df34c90b |
| Package id | 10-14272-qcgqheftblbccj-jlxbfwjwsa-n-chmo0000597-1 |
| Resource type | HTML |
| State | active |