1H nuclear magnetic resonance spectroscopy (1H NMR)
URL: https://www.chemotion-repository.net/inchikey/CRHQCXFMPCYLGU-RGNLWQAKSA-N/CHMO0000593
Dataset description:
dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR)\n\n
Chemical Info
| InChI | InChI=1S/C52H42N4O6/c1-5-61-51(57)35-11-7-31(8-12-35)47-39-23-27-43(53-39)49(33-15-19-37(59-3)20-16-33)45-29-25-41(55-45)48(32-9-13-36(14-10-32)52(58)62-6-2)42-26-30-46(56-42)50(44-28-24-40(47)54-44)34-17-21-38(60-4)22-18-34/h7-30,53,56H,5-6H2,1-4H3/b47-39-,47-40-,48-41-,48-42-,49-43-,49-45-,50-44-,50-46- |
|---|---|
| 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)/c1ccc(cc1)OC)/C=C3)\c1ccc(cc1)C(=O)OCC)/[nH]2)/c1ccc(cc1)OC |
| InChI Key | CRHQCXFMPCYLGU-RGNLWQAKSA-N |
| Molecular Formula | C52H42N4O6 |
| Exact Mass | 818.913 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 | 5335721e-19b5-4431-bbd0-e66f6107176d |
| Package id | 10-14272-crhqcxfmpcylgu-rgnlwqaksa-n-chmo0000593 |
| Resource type | HTML |
| State | active |