Dataset

electron ionisation mass spectrometry (EI-MS)

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

Chemical Info

molecular Image
InChI InChI=1S/C12H12N2/c1-10-4-6-11(7-5-10)14-9-12-3-2-8-13-12/h2-9,13H,1H3/b14-9+
SMILES Cc1ccc(cc1)/N=C/c1ccc[nH]1
InChI Key UTSSSVWAYAQTOV-NTEUORMPSA-N
Molecular Formula C12H12N2
Exact Mass 184.237 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/UTSSSVWAYAQTOV-NTEUORMPSA-N/CHMO0000480
License URL
Source https://www.chemotion-repository.net/inchikey/UTSSSVWAYAQTOV-NTEUORMPSA-N/CHMO0000480
Version
Author Valentina Ferraro
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-08T03:13:46.350292
MetadataModified 2024-09-08T03:13:46.350297
MetadataPublished 2024-04-17
Field Value
Measurement Technique electron ionisation mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
J1.434.418G Nikkaji
SCHEMBL14421110 SureChEMBL
The data in this table is sourced from UniChem at EBI.