Dataset
mass spectrometry (MS)
Chemical Info
InChI | InChI=1S/C32H32N2.2HI/c1-33-19-15-25(16-20-33)5-11-31-23-27-3-4-28-8-10-30(14-13-29(31)9-7-27)32(24-28)12-6-26-17-21-34(2)22-18-26;;/h5-12,15-24H,3-4,13-14H2,1-2H3;2*1H/q+2;;/p-2/b11-5+,12-6+;; |
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SMILES | C[n+]1ccc(cc1)/C=C/c1cc2ccc1CCc1ccc(CC2)cc1/C=C/c1cc[n+](cc1)C.[I-].[I-] |
InChI Key | LDXRSQKGYPSETL-HUJVKZLISA-L |
Molecular Formula | C32H32I2N2 |
Exact Mass | 698.419 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.14272/LDXRSQKGYPSETL-HUJVKZLISA-L/CHMO0000470 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/LDXRSQKGYPSETL-HUJVKZLISA-L/CHMO0000470 |
Version | |
Author | Yichuan Wang |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-08T04:11:24.232943 |
MetadataModified | 2024-09-08T04:11:24.232947 |
MetadataPublished | 2024-07-10 |
Field | Value |
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Measurement Technique | mass spectrometry |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
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No additional information available for this Dataset. |