Dataset

electron ionisation mass spectrometry (EI-MS)

dataset for electron ionisation mass spectrometry (EI-MS)\n\n

Chemical Info

molecular Image
InChI InChI=1S/C17H15BrN2OS2/c18-16(17-22-11-4-12-23-17)20-19-13-7-9-15(10-8-13)21-14-5-2-1-3-6-14/h1-3,5-10H,4,11-12H2/b20-19+
SMILES BrC(=C1SCCCS1)/N=N/c1ccc(cc1)Oc1ccccc1
InChI Key AOQRZPCEVXTULO-FMQUCBEESA-N
Molecular Formula C17H15BrN2OS2
Exact Mass 407.348 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/AOQRZPCEVXTULO-FMQUCBEESA-N/Mass/EI
License URL
Source https://www.chemotion-repository.net/inchikey/AOQRZPCEVXTULO-FMQUCBEESA-N/Mass/EI
Version
Author Bettina Stanek
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-06T22:49:22.663963
MetadataModified 2024-09-07T12:26:51.756745
MetadataPublished 2014-05-27
Field Value
Measurement Technique electron ionisation mass spectrometry
Measurement Variables