Dataset

Orotic acid; LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M+H]+

This MassBank record with Accession MSBNK-RIKEN-PR100186 contains the MS2 mass spectrum of Orotic acid with the InChIkey PXQPEWDEAKTCGB-UHFFFAOYSA-N.

Chemical Information

Molecular Image

InChI	InChI=1S/C5H4N2O4/c8-3-1-2(4(9)10)6-5(11)7-3/h1H,(H,9,10)(H2,6,7,8,11)
SMILES	O=C(N1)C=C(NC(=O)1)C(O)=O
InChI Key	PXQPEWDEAKTCGB-UHFFFAOYSA-N
Molecular Formula	C5H4N2O4
Exact Mass	156.017 g/mol

Data and Resources

Orotic acidHTML

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Related Molecule ⌄

2,4-dioxo-1H-pyrimidine-6-carboxylic acid

Metadata Information

Field	Value
DOI
License URL	https://creativecommons.org/licenses/by-sa/4.0
Source	https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR100186
Version
Author
Maintainer
Language
MetadataPublished	2016-01-19
Related Molecule	2,4-dioxo-1H-pyrimidine-6-carboxylic acid

Field	Value
Measurement Technique	liquid chromatography-mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
No additional information available for this Dataset.