Dataset
electron ionisation mass spectrometry (EI-MS)
Chemical Info
InChI | InChI=1S/C12H12N2/c1-10-4-6-11(7-5-10)14-9-12-3-2-8-13-12/h2-9,13H,1H3/b14-9+ |
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SMILES | Cc1ccc(cc1)/N=C/c1ccc[nH]1 |
InChI Key | UTSSSVWAYAQTOV-NTEUORMPSA-N |
Molecular Formula | C12H12N2 |
Exact Mass | 184.237 g/mol |
Data and Resources
Metadata Information
Field | Value |
---|---|
DOI | 10.14272/UTSSSVWAYAQTOV-NTEUORMPSA-N/CHMO0000480 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/UTSSSVWAYAQTOV-NTEUORMPSA-N/CHMO0000480 |
Version | |
Author | Valentina Ferraro |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-08T03:13:46.350292 |
MetadataModified | 2024-09-08T03:13:46.350297 |
MetadataPublished | 2024-04-17 |
Field | Value |
---|---|
Measurement Technique | electron ionisation mass spectrometry |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
---|---|
J1.434.418G | Nikkaji |
SCHEMBL14421110 | SureChEMBL |
The data in this table is sourced from UniChem at EBI. |