Dataset
electron ionisation mass spectrometry (EI-MS)
Chemical Info
InChI | InChI=1S/C14H12ClNO/c15-10-14(17)16-13-9-5-4-8-12(13)11-6-2-1-3-7-11/h1-9H,10H2,(H,16,17) |
---|---|
SMILES | ClCC(=O)Nc1ccccc1c1ccccc1 |
InChI Key | BDDDKTKNLZLTQD-UHFFFAOYSA-N |
Molecular Formula | C14H12ClNO |
Exact Mass | 245.704 g/mol |
Data and Resources
Metadata Information
Field | Value |
---|---|
DOI | 10.14272/BDDDKTKNLZLTQD-UHFFFAOYSA-N/Mass/EI |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/BDDDKTKNLZLTQD-UHFFFAOYSA-N/Mass/EI |
Version | |
Author | Simone Gräßle |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-06T22:41:50.024913 |
MetadataModified | 2024-09-07T12:05:09.682870 |
MetadataPublished | 2014-05-27 |
Field | Value |
---|---|
Measurement Technique | electron ionisation mass spectrometry |
Measurement Variables |