Dataset

PYRIDINE-N-OXIDE; EI-B; MS

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP005728 contains the MS mass spectrum of PYRIDINE-N-OXIDE with the InChIkey ILVXOBCQQYKLDS-UHFFFAOYSA-N.

Chemical Information

molecular Image

InChI	InChI=1S/C5H5NO/c7-6-4-2-1-3-5-6/h1-5H
SMILES	[O-1][n+1](c1)cccc1
InChI Key	ILVXOBCQQYKLDS-UHFFFAOYSA-N
Molecular Formula	C5H5NO
Exact Mass	95.037 g/mol

Data and Resources

PYRIDINE-N-OXIDEHTML

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Related Molecule ⌄

1-oxidopyridin-1-ium

Metadata Information

Field	Value
DOI
License URL	https://creativecommons.org/licenses/by-nc-sa/4.0
Source	https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Fac_Eng_Univ_Tokyo-JP005728
Version
Author
Maintainer
Language
MetadataPublished	2016-01-19
Related Molecule	1-oxidopyridin-1-ium

Field	Value
Measurement Technique	liquid chromatography-mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
CHEBI:29136	chebi
9PO	rcsb_pdb
CHEMBL3278446	chembl
1316	surechembl
12753	pubchem
91F12JJJ4H	fdasrs
PYRDNO	CCDC
165854	brenda
1688	brenda
HMDB0256967	hmdb
Molport-001-779-833	molport
Molport-053-145-753	molport
The data in this table is sourced from UniChem at EBI.