Dataset

Folic acid; LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-

This MassBank record with Accession MSBNK-LCSB-LU045252 contains the MS2 mass spectrum of Folic acid with the InChIkey OVBPIULPVIDEAO-LBPRGKRZSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C19H19N7O6/c20-19-25-15-14(17(30)26-19)23-11(8-22-15)7-21-10-3-1-9(2-4-10)16(29)24-12(18(31)32)5-6-13(27)28/h1-4,8,12,21H,5-7H2,(H,24,29)(H,27,28)(H,31,32)(H3,20,22,25,26,30)/t12-/m0/s1
SMILES NC1=NC(=O)C2=C(N1)N=CC(CNC1=CC=C(C=C1)C(=O)N[C@@H](CCC(O)=O)C(O)=O)=N2
InChI Key OVBPIULPVIDEAO-LBPRGKRZSA-N
Molecular Formula C19H19N7O6
Exact Mass 441.140 g/mol

Data and Resources

Metadata Information

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DOI
License URL https://creativecommons.org/licenses/by/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-LCSB-LU045252
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MetadataPublished 2020-08-19
Related Molecule
  • (2S)-2-[[4-[(2-amino-4-oxo-1H-pteridin-6-yl)methylamino]benzoyl]amino]pentanedioic acid
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    No additional information available for this Dataset.