1H nuclear magnetic resonance spectroscopy (1H NMR)
URL: https://www.chemotion-repository.net/inchikey/GJXVXQKLCLKLLN-NVZKTODFSA-N/CHMO0000593
Dataset description:
dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR)\n\n
Chemical Info
| InChI | InChI=1S/C45H34N4O5/c1-3-53-44(51)29-13-9-27(10-14-29)41-35-19-17-32(46-35)25-33-18-20-36(47-33)42(28-11-15-30(16-12-28)45(52)54-4-2)38-22-24-40(49-38)43(39-23-21-37(41)48-39)34-8-6-5-7-31(34)26-50/h5-26,46,49H,3-4H2,1-2H3/b32-25-,33-25-,41-35-,41-37-,42-36-,42-38-,43-39-,43-40- |
|---|---|
| SMILES | CCOC(=O)c1ccc(cc1)/C/1=C/2\C=CC(=N2)/C=c\2/cc/c(=C(/C3=N/C(=C(\c4[nH]c1cc4)/c1ccccc1C=O)/C=C3)\c1ccc(cc1)C(=O)OCC)/[nH]2 |
| InChI Key | GJXVXQKLCLKLLN-NVZKTODFSA-N |
| Molecular Formula | C45H34N4O5 |
| Exact Mass | 710.775 g/mol |
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Additional Information
| Field | Value |
|---|---|
| Data last updated | September 7, 2024 |
| Metadata last updated | September 7, 2024 |
| Created | September 7, 2024 |
| Format | HTML |
| License | No License Provided |
| Id | dc4cf5ce-f61e-4e32-bb09-1d5b94f20e9d |
| Package id | 10-14272-gjxvxqklclklln-nvzktodfsa-n-chmo0000593 |
| Resource type | HTML |
| State | active |