Dataset
ultraviolet-visible spectrophotometry (UV-VIS)
Chemical Info
InChI | InChI=1S/C49H44N6O/c1-3-4-5-6-7-18-31-56-49-46(52-42-25-16-17-26-43(42)55-49)30-29-45-44(28-27-39-34(2)50-40-23-14-15-24-41(40)51-39)53-47-32-37(35-19-10-8-11-20-35)38(33-48(47)54-45)36-21-12-9-13-22-36/h8-17,19-30,32-33H,3-7,18,31H2,1-2H3/b28-27+,30-29+ |
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SMILES | CCCCCCCCOc1nc2ccccc2nc1/C=C/c1nc2cc(c3ccccc3)c(cc2nc1/C=C/c1nc2ccccc2nc1C)c1ccccc1 |
InChI Key | LKSMCVFTDQIOMY-XOXGWFOHSA-N |
Molecular Formula | C49H44N6O |
Exact Mass | 732.913 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.14272/LKSMCVFTDQIOMY-XOXGWFOHSA-N/CHMO0000292.1 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/LKSMCVFTDQIOMY-XOXGWFOHSA-N/CHMO0000292.1 |
Version | |
Author | Jérôme Klein |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-07T06:29:22.830558 |
MetadataModified | 2024-09-07T22:06:26.238765 |
MetadataPublished | 2022-04-17 |
Field | Value |
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Measurement Technique | ultraviolet-visible spectrophotometry |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
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163197179 | PubChem |
The data in this table is sourced from UniChem at EBI. |