Dataset

electron ionisation mass spectrometry (EI-MS)

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

Chemical Info

molecular Image
InChI InChI=1S/C13H12F3N3O/c1-7(2)6-10(20)17-12-8-4-3-5-9(13(14,15)16)11(8)18-19-12/h3-6H,1-2H3,(H2,17,18,19,20)
SMILES O=C(Nc1n[nH]c2c1cccc2C(F)(F)F)C=C(C)C
InChI Key SMGJSDCXNIXMQR-UHFFFAOYSA-N
Molecular Formula C13H12F3N3O
Exact Mass 283.249 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/SMGJSDCXNIXMQR-UHFFFAOYSA-N/Mass/EI.1
License URL
Source https://www.chemotion-repository.net/inchikey/SMGJSDCXNIXMQR-UHFFFAOYSA-N/Mass/EI.1
Version
Author Ana María García
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-06T21:32:47.591175
MetadataModified 2024-09-07T14:05:15.971860
MetadataPublished 2015-06-09
Field Value
Measurement Technique electron ionisation mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
91808061 PubChem
The data in this table is sourced from UniChem at EBI.