Dataset
electron ionisation mass spectrometry (EI-MS)
Chemical Information
| InChI | InChI=1S/C16H15NO2S/c1-3-17(13-15-7-5-4-6-8-15)20(18,19)16-11-9-14(2)10-12-16/h1,4-12H,13H2,2H3 |
|---|---|
| SMILES | C#CN(S(=O)(=O)c1ccc(cc1)C)Cc1ccccc1 |
| InChI Key | VLGDAJJQNOQJRW-UHFFFAOYSA-N |
| Molecular Formula | C16H15NO2S |
| Exact Mass | 285.361 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | 10.14272/VLGDAJJQNOQJRW-UHFFFAOYSA-N/Mass/EI.1 |
| License URL | |
| Source | https://www.chemotion-repository.net/inchikey/VLGDAJJQNOQJRW-UHFFFAOYSA-N/Mass/EI.1 |
| Version | |
| Author | Tim Wezeman |
| Maintainer | Chemotion Repository |
| Language | english |
| MetadataPublished | 2014-08-14 |
| Related Molecule |
|
| Field | Value |
|---|---|
| Measurement Technique | electron ionisation mass spectrometry |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| No additional information available for this Dataset. | |