Dataset

electron ionisation mass spectrometry (EI-MS)

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

Chemical Info

molecular Image
InChI InChI=1S/C16H22F3N3O2/c1-6-24-15(23)12-7-8-14(13(9-12)16(17,18)19)20-21-22(10(2)3)11(4)5/h7-11H,6H2,1-5H3/b21-20+
SMILES CCOC(=O)c1ccc(c(c1)C(F)(F)F)/N=N/N(C(C)C)C(C)C
InChI Key GUVBZGBNNQJRGH-QZQOTICOSA-N
Molecular Formula C16H22F3N3O2
Exact Mass 345.360 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/GUVBZGBNNQJRGH-QZQOTICOSA-N/Mass/EI
License URL
Source https://www.chemotion-repository.net/inchikey/GUVBZGBNNQJRGH-QZQOTICOSA-N/Mass/EI
Version
Author Andreas Hafner
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-06T23:34:03.717047
MetadataModified 2024-09-07T12:47:27.296970
MetadataPublished 2014-05-27
Field Value
Measurement Technique electron ionisation mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
J3.081.928D Nikkaji
The data in this table is sourced from UniChem at EBI.