Dataset

5-Fluorouracil; LC-ESI-QFT; MS2; CE: 90%; R=15000; [M+H]+

This MassBank record with Accession MSBNK-Eawag-EQ00256606 contains the MS2 mass spectrum of 5-Fluorouracil with the InChIkey GHASVSINZRGABV-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C4H3FN2O2/c5-2-1-6-4(9)7-3(2)8/h1H,(H2,6,7,8,9)
SMILES FC1=CNC(=O)NC1=O
InChI Key GHASVSINZRGABV-UHFFFAOYSA-N
Molecular Formula C4H3FN2O2
Exact Mass 130.018 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Eawag-EQ00256606
Version
Author
Maintainer
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MetadataPublished 2024-06-14
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  • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    DB00544 drugbank
    URF rcsb_pdb
    CHEMBL185 chembl
    3646 surechembl
    592897 surechembl
    3385 pubchem
    U3P01618RT fdasrs
    4789 gtopdb
    PD002327 probes_and_drugs
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    155282 brenda
    176866 brenda
    190396 brenda
    229064 brenda
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    51649 brenda
    812 brenda
    84162 brenda
    URF pdbe
    CHEBI:46345 chebi
    HMDB0014684 hmdb
    DTXSID2020634 comptox
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    NCT05998447 clinicaltrials
    NCT06002789 clinicaltrials
    NCT06003998 clinicaltrials
    NCT06006650 clinicaltrials
    NCT06010888 clinicaltrials
    NCT06011772 clinicaltrials
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    NCT06022861 clinicaltrials
    NCT06028737 clinicaltrials
    NCT06047379 clinicaltrials
    NCT06048484 clinicaltrials
    NCT06057038 clinicaltrials
    NCT06062602 clinicaltrials
    NCT06062602 clinicaltrials
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    NCT06093425 clinicaltrials
    NCT06093425 clinicaltrials
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    NCT06096220 clinicaltrials
    NCT06099951 clinicaltrials
    NCT06102395 clinicaltrials
    NCT06106308 clinicaltrials
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    NCT06150144 clinicaltrials
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    NCT06153368 clinicaltrials
    NCT06154538 clinicaltrials
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    NCT06360354 clinicaltrials
    NCT06363552 clinicaltrials
    NCT06365008 clinicaltrials
    NCT06370754 clinicaltrials
    NCT06381154 clinicaltrials
    NCT06383078 clinicaltrials
    NCT06384560 clinicaltrials
    NCT06389500 clinicaltrials
    NCT06389760 clinicaltrials
    NCT06396091 clinicaltrials
    NCT06409637 clinicaltrials
    NCT06417476 clinicaltrials
    NCT06420440 clinicaltrials
    NCT06428409 clinicaltrials
    NCT06441565 clinicaltrials
    NCT06445062 clinicaltrials
    NCT06446388 clinicaltrials
    NCT06447662 clinicaltrials
    NCT06461442 clinicaltrials
    NCT06469944 clinicaltrials
    NCT06475326 clinicaltrials
    NCT06475352 clinicaltrials
    NCT06483555 clinicaltrials
    Molport-000-156-102 molport
    Molport-003-990-447 molport
    26 drugcentral
    50340677 bindingdb
    The data in this table is sourced from UniChem at EBI.