mass spectrometry (MS)
URL: https://www.chemotion-repository.net/inchikey/TVEBQXAMVVZGLS-LLAQAHTDSA-N/CHMO0000470
Chemical Info
InChI | InChI=1S/C70H46N4O4/c1-3-77-69(75)47-19-15-45(16-20-47)65-53-31-35-57(71-53)67(51-29-25-43-13-11-39-7-5-9-41-23-27-49(51)63(43)61(39)41)59-37-33-55(73-59)66(46-17-21-48(22-18-46)70(76)78-4-2)56-34-38-60(74-56)68(58-36-32-54(65)72-58)52-30-26-44-14-12-40-8-6-10-42-24-28-50(52)64(44)62(40)42/h5-38,71,74H,3-4H2,1-2H3/b65-53-,65-54-,66-55-,66-56-,67-57-,67-59-,68-58-,68-60- |
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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)/c1ccc4c5c1ccc1c5c(cc4)ccc1)/C=C3)\c1ccc(cc1)C(=O)OCC)/[nH]2)/c1ccc2c3c1ccc1c3c(cc2)ccc1 |
InChI Key | TVEBQXAMVVZGLS-LLAQAHTDSA-N |
Molecular Formula | C70H46N4O4 |
Exact Mass | 1007.139 g/mol |
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Additional Information
Field | Value |
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Data last updated | September 7, 2024 |
Metadata last updated | September 7, 2024 |
Created | September 7, 2024 |
Format | HTML |
License | No License Provided |
Id | f454148f-538a-46ae-98ed-e65ac33df24b |
Package id | 10-14272-tvebqxamvvzgls-llaqahtdsa-n-chmo0000470 |
Resource type | HTML |
State | active |