1H nuclear magnetic resonance spectroscopy (1H NMR)
URL: https://www.chemotion-repository.net/inchikey/VGNCSFRFEFFGRB-DAJBKUBHSA-N/1HNMR
Dataset description:
dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR)\n\n
Chemical Info
| InChI | InChI=1S/C44H27BrN4.Zn/c45-32-18-16-31(17-19-32)44-39-26-24-37(48-39)42(29-12-6-2-7-13-29)35-22-20-33(46-35)41(28-10-4-1-5-11-28)34-21-23-36(47-34)43(30-14-8-3-9-15-30)38-25-27-40(44)49-38;/h1-27H;/q-2;+2/b41-33-,41-34-,42-35-,42-37-,43-36-,43-38-,44-39-,44-40-; |
|---|---|
| SMILES | Brc1ccc(cc1)/C/1=C/2\C=CC(=N2)/C(=c/2\n3[Zn]n4c1ccc4/C(=C\1/C=CC(=N1)/C(=c\3/cc2)/c1ccccc1)/c1ccccc1)/c1ccccc1 |
| InChI Key | VGNCSFRFEFFGRB-DAJBKUBHSA-N |
| Molecular Formula | C44H27BrN4Zn |
| Exact Mass | 756.996 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 | c4d13ef7-66a3-49a6-ae2e-ead6fff84908 |
| Package id | 10-14272-vgncsfrfeffgrb-dajbkubhsa-n-1hnmr |
| Resource type | HTML |
| State | active |