Dataset
electron ionisation mass spectrometry (EI-MS)
Chemical Info
InChI | InChI=1S/C16H15N3/c17-19-18-16-11-14-6-5-12-1-3-13(4-2-12)7-9-15(16)10-8-14/h1-4,8,10-11H,5-7,9H2 |
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SMILES | [N-]=[N+]=Nc1cc2CCc3ccc(CCc1cc2)cc3 |
InChI Key | BWVPTMJTRJUYPG-UHFFFAOYSA-N |
Molecular Formula | C16H15N3 |
Exact Mass | 249.310 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.14272/BWVPTMJTRJUYPG-UHFFFAOYSA-N/CHMO0000480 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/BWVPTMJTRJUYPG-UHFFFAOYSA-N/CHMO0000480 |
Version | |
Author | Tilman Hans Köhler |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-08T03:39:44.943014 |
MetadataModified | 2024-09-08T03:39:44.943020 |
MetadataPublished | 2024-05-21 |
Field | Value |
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Measurement Technique | electron ionisation mass spectrometry |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
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J2.966.511G | Nikkaji |
101805696 | PubChem |
The data in this table is sourced from UniChem at EBI. |