MassBank Record: MSBNK-EPA-ENTACT_AGILENT001538
ACCESSION: MSBNK-EPA-ENTACT_AGILENT001538
RECORD_TITLE: 2,4-Dihydroxypyridine; ESI-QTOF; MS2; CE: 20; [M-H]-
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY
CH$NAME: 2,4-Dihydroxypyridine
CH$NAME: DTXSID90274238
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C5H5NO2
CH$EXACT_MASS: 111.0320284115
CH$SMILES: OC1=CC(O)=NC=C1
CH$IUPAC: InChI=1S/C5H5NO2/c7-4-1-2-6-5(8)3-4/h1-3H,(H2,6,7,8)
CH$LINK: CAS
626-03-9
CH$LINK: INCHIKEY
ZEZJPIDPVXJEME-UHFFFAOYSA-N
CH$LINK: PUBCHEM
CID:54696004
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 20
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: splash10-014l-9000000000-f22c6920f780e5ff9566
PK$NUM_PEAK: 13
PK$PEAK: m/z int. rel.int.
39.024024 31.364069 313
40.019273 13.144117 131
41.003288 100.000003 999
41.027098 2.446219 24
41.998537 1.519653 15
49.008374 2.275108 22
64.019273 1.449148 14
65.998537 4.480185 44
66.034923 70.123186 700
67.018938 1.877627 18
68.014187 54.633782 545
68.998203 15.918172 159
110.024752 11.578008 115
//