1H nuclear magnetic resonance spectroscopy (1H NMR)
URL: https://www.chemotion-repository.net/inchikey/QKHPYPUCYCZMQU-WTFXTOSCSA-N/CHMO0000593
Dataset description:
dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR)\n\n
Chemical Info
| InChI | InChI=1S/C38H30N4O4/c1-3-45-37(43)25-9-5-23(6-10-25)35-31-17-13-27(39-31)21-29-15-19-33(41-29)36(24-7-11-26(12-8-24)38(44)46-4-2)34-20-16-30(42-34)22-28-14-18-32(35)40-28/h5-22,39,42H,3-4H2,1-2H3/b27-21-,28-22-,29-21-,30-22-,35-31-,35-32-,36-33-,36-34- |
|---|---|
| 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)/C=C3)\c1ccc(cc1)C(=O)OCC)/[nH]2 |
| InChI Key | QKHPYPUCYCZMQU-WTFXTOSCSA-N |
| Molecular Formula | C38H30N4O4 |
| Exact Mass | 606.669 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 | a5234d20-ab01-4b9c-a63b-a3eff79fd615 |
| Package id | 10-14272-qkhpypucyczmqu-wtfxtoscsa-n-chmo0000593 |
| Resource type | HTML |
| State | active |