Dataset

electron ionisation mass spectrometry (EI-MS)

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

Chemical Info

molecular Image
InChI InChI=1S/C31H24ClN/c32-27-6-3-5-25(19-27)29-20-26-4-1-2-7-30(26)33-31(29)28-18-23-13-12-21-8-10-22(11-9-21)14-16-24(28)17-15-23/h1-11,15,17-20H,12-14,16H2
SMILES Clc1cccc(c1)c1cc2ccccc2nc1c1cc2CCc3ccc(CCc1cc2)cc3
InChI Key ZMNGZXQVAJHOGB-UHFFFAOYSA-N
Molecular Formula C31H24ClN
Exact Mass 445.982 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/ZMNGZXQVAJHOGB-UHFFFAOYSA-N/CHMO0000480.1
License URL
Source https://www.chemotion-repository.net/inchikey/ZMNGZXQVAJHOGB-UHFFFAOYSA-N/CHMO0000480.1
Version
Author Tilman Hans Köhler
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-08T03:28:15.093637
MetadataModified 2024-09-08T03:28:15.093643
MetadataPublished 2024-05-21
Field Value
Measurement Technique electron ionisation mass spectrometry
Measurement Variables