Dataset
electron ionisation mass spectrometry (EI-MS)
Chemical Info
InChI | InChI=1S/C18H18N2OS2/c21-13-14-6-4-9-16(12-14)19-20-17(15-7-2-1-3-8-15)18-22-10-5-11-23-18/h1-4,6-9,12,21H,5,10-11,13H2/b20-19+ |
---|---|
SMILES | OCc1cccc(c1)/N=N/C(=C1SCCCS1)c1ccccc1 |
InChI Key | ADTLMTMRZNXYOP-FMQUCBEESA-N |
Molecular Formula | C18H18N2OS2 |
Exact Mass | 342.478 g/mol |
Data and Resources
Metadata Information
Field | Value |
---|---|
DOI | 10.14272/ADTLMTMRZNXYOP-FMQUCBEESA-N/Mass/EI |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/ADTLMTMRZNXYOP-FMQUCBEESA-N/Mass/EI |
Version | |
Author | Bettina Stanek |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-06T23:51:37.346650 |
MetadataModified | 2024-09-07T13:13:32.465896 |
MetadataPublished | 2014-05-27 |
Field | Value |
---|---|
Measurement Technique | electron ionisation mass spectrometry |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
---|---|
No additional information available for this Dataset. |