infrared absorption spectroscopy (IR)
URL: https://www.chemotion-repository.net/inchikey/FVHZCBQLLFLQAG-LWQDQPMZSA-N/IR
Dataset description:
dataset for infrared absorption spectroscopy (IR)\n\n
Chemical Info
InChI | InChI=1S/C44H26N8O8/c53-49(54)29-9-1-25(2-10-29)41-33-17-19-35(45-33)42(26-3-11-30(12-4-26)50(55)56)37-21-23-39(47-37)44(28-7-15-32(16-8-28)52(59)60)40-24-22-38(48-40)43(36-20-18-34(41)46-36)27-5-13-31(14-6-27)51(57)58/h1-24,45,48H/b41-33-,41-34-,42-35-,42-37-,43-36-,43-38-,44-39-,44-40- |
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SMILES | [O-][N+](=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)[N+](=O)[O-])/C=C3)\c1ccc(cc1)[N+](=O)[O-])/[nH]2)/c1ccc(cc1)[N+](=O)[O-] |
InChI Key | FVHZCBQLLFLQAG-LWQDQPMZSA-N |
Molecular Formula | C44H26N8O8 |
Exact Mass | 794.726 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 | 60199b91-c700-45b9-b5bb-4abfaa02d3a4 |
Package id | 10-14272-fvhzcbqllflqag-lwqdqpmzsa-n-ir |
Resource type | HTML |
State | active |