mass spectrometry (MS)
URL: https://www.chemotion-repository.net/inchikey/UKPDOEPTPHHMKQ-DAJBKUBHSA-N/Mass.1
Chemical Info
InChI | InChI=1S/C44H27BrN4.Cu/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-; |
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SMILES | Brc1ccc(cc1)/C/1=C/2\C=CC(=N2)/C(=c/2\n3[Cu]n4c1ccc4/C(=C\1/C=CC(=N1)/C(=c\3/cc2)/c1ccccc1)/c1ccccc1)/c1ccccc1 |
InChI Key | UKPDOEPTPHHMKQ-DAJBKUBHSA-N |
Molecular Formula | C44H27BrCuN4 |
Exact Mass | 755.162 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 | 5dfd9c73-6f7d-4388-a6cd-bcca9b1a245c |
Package id | 10-14272-ukpdoeptphhmkq-dajbkubhsa-n-mass-1 |
Resource type | HTML |
State | active |