Dataset
electron ionisation mass spectrometry (EI-MS)
Chemical Info
InChI | InChI=1S/C22H18N2OS2/c1-3-7-17(8-4-1)21(22-26-15-16-27-22)24-23-18-11-13-20(14-12-18)25-19-9-5-2-6-10-19/h1-14H,15-16H2/b24-23+ |
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SMILES | c1ccc(cc1)Oc1ccc(cc1)/N=N/C(=C1SCCS1)c1ccccc1 |
InChI Key | XXLMGNOUXDIRRQ-WCWDXBQESA-N |
Molecular Formula | C22H18N2OS2 |
Exact Mass | 390.521 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.14272/XXLMGNOUXDIRRQ-WCWDXBQESA-N/Mass/EI |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/XXLMGNOUXDIRRQ-WCWDXBQESA-N/Mass/EI |
Version | |
Author | Bettina Stanek |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-06T23:26:11.575651 |
MetadataModified | 2024-09-07T12:35:36.431155 |
MetadataPublished | 2014-05-27 |
Field | Value |
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Measurement Technique | electron ionisation mass spectrometry |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
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No additional information available for this Dataset. |