Dataset

electron ionisation mass spectrometry (EI-MS)

Chemical Info

InChI	InChI=1S/C10H6F3NO3/c11-10(12,13)9-14-7(8(16)17-9)5-1-3-6(15)4-2-5/h1-4,9,15H
SMILES	FC(C1N=C(C(=O)O1)c1ccc(cc1)O)(F)F
InChI Key	OFTIAEDMYBUFRK-UHFFFAOYSA-N
Molecular Formula	C10H6F3NO3
Exact Mass	245.155 g/mol

Data and Resources

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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/OFTIAEDMYBUFRK-UHFFFAOYSA-N/Mass/EI.1
License URL
Source	https://www.chemotion-repository.net/inchikey/OFTIAEDMYBUFRK-UHFFFAOYSA-N/Mass/EI.1
Version
Author	Simone Gräßle
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-06T21:33:57.484861
MetadataModified	2024-09-07T14:06:49.529281
MetadataPublished	2015-08-06

Field	Value
Measurement Technique	electron ionisation mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
136666740	PubChem
J3.541.630G	Nikkaji
The data in this table is sourced from UniChem at EBI.