Dataset
mass spectrometry (MS)
Chemical Info
InChI | InChI=1S/C22H21N4.ClH/c1-26-13-12-20(22(15-26)24-25-23)21-14-18-7-6-16-2-4-17(5-3-16)8-10-19(21)11-9-18;/h2-5,9,11-15H,6-8,10H2,1H3;1H/q+1;/p-1 |
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SMILES | [N-]=[N+]=Nc1c[n+](C)ccc1c1cc2ccc1CCc1ccc(CC2)cc1.[Cl-] |
InChI Key | YVHVOAZMKUDAFB-UHFFFAOYSA-M |
Molecular Formula | C22H21ClN4 |
Exact Mass | 376.882 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.14272/YVHVOAZMKUDAFB-UHFFFAOYSA-M/CHMO0000470 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/YVHVOAZMKUDAFB-UHFFFAOYSA-M/CHMO0000470 |
Version | |
Author | Stefan Bräse |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-08T03:02:16.733193 |
MetadataModified | 2024-09-08T03:02:16.733199 |
MetadataPublished | 2024-02-15 |
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. |