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MassBank Record: MSBNK-EPA-ENTACT_AGILENT000794

2,6-Dihydroxypyridine; ESI-QTOF; MS2; CE: 40; [M-H]-

Mass Spectrum
35.0040.0045.0050.0055.0060.0065.0070.00m/z0.000200.0400.0600.0800.01000Abundance
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk)

ACCESSION: MSBNK-EPA-ENTACT_AGILENT000794
RECORD_TITLE: 2,6-Dihydroxypyridine; ESI-QTOF; MS2; CE: 40; [M-H]-
DATE: 2023.05.02
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: 2,6-Dihydroxypyridine
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C5H5NO2
CH$EXACT_MASS: 111.0320284115
CH$SMILES: OC1=CC=CC(=O)N1
CH$IUPAC: InChI=1S/C5H5NO2/c7-4-2-1-3-5(8)6-4/h1-3H,(H2,6,7,8)
CH$LINK: CAS 626-06-2
CH$LINK: INCHIKEY WLFXSECCHULRRO-UHFFFAOYSA-N

AC$INSTRUMENT: N/A
AC$INSTRUMENT_TYPE: ESI-QTOF
AC$MASS_SPECTROMETRY: MS_TYPE MS2
AC$MASS_SPECTROMETRY: ION_MODE NEGATIVE
AC$MASS_SPECTROMETRY: IONIZATION ESI
AC$MASS_SPECTROMETRY: COLLISION_ENERGY 40

MS$FOCUSED_ION: PRECURSOR_M/Z 110.0247519598
MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-0006-9000000000-4719627dcd3d242ff324
PK$NUM_PEAK: 10
PK$PEAK: m/z int. rel.int.
  39.024024 2.413518 24
  40.019273 100.000003 999
  41.003288 42.025006 419
  41.998537 30.385815 303
  49.008374 4.185494 41
  50.003623 16.719699 167
  64.019273 4.630939 46
  65.003288 6.232268 62
  66.034923 8.383555 83
  67.018938 1.795869 17
//

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Responsible: Tillmann G. Fischer

Funded by the Deutsche Forschungsgemeinschaft (DFG, German Research Foundation) under the National Research Data Infrastructure – NFDI4Chem – Projektnummer 441958208.

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