Dataset

electron ionisation mass spectrometry (EI-MS)

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

Chemical Info

molecular Image
InChI InChI=1S/C15H8F5N3O/c16-9-5-2-6-10(17)11(9)14(24)21-13-7-3-1-4-8(15(18,19)20)12(7)22-23-13/h1-6H,(H2,21,22,23,24)
SMILES O=C(c1c(F)cccc1F)Nc1n[nH]c2c1cccc2C(F)(F)F
InChI Key PDOBPDRIEALUTQ-UHFFFAOYSA-N
Molecular Formula C15H8F5N3O
Exact Mass 341.236 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/PDOBPDRIEALUTQ-UHFFFAOYSA-N/Mass/EI.1
License URL
Source https://www.chemotion-repository.net/inchikey/PDOBPDRIEALUTQ-UHFFFAOYSA-N/Mass/EI.1
Version
Author Ana María García
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-06T21:33:25.195385
MetadataModified 2024-09-07T14:06:28.730412
MetadataPublished 2015-06-09
Field Value
Measurement Technique electron ionisation mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
91808066 PubChem
The data in this table is sourced from UniChem at EBI.