MassBank Record: MSBNK-EPA-ENTACT_AGILENT001573
ACCESSION: MSBNK-EPA-ENTACT_AGILENT001573
RECORD_TITLE: 4-Hydroxy-3-methoxypyridine; ESI-QTOF; MS2; CE: 40; [M+H]+
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY
CH$NAME: 4-Hydroxy-3-methoxypyridine
CH$NAME: DTXSID80198757
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C6H7NO2
CH$EXACT_MASS: 125.0476784753
CH$SMILES: COC1C=NC=CC=1O
CH$IUPAC: InChI=1S/C6H7NO2/c1-9-6-4-7-3-2-5(6)8/h2-4H,1H3,(H,7,8)
CH$LINK: CAS
62885-41-0
CH$LINK: INCHIKEY
XKECCYGTTKNLOC-UHFFFAOYSA-N
CH$LINK: PUBCHEM
CID:186643
AC$INSTRUMENT: N/A
AC$INSTRUMENT_TYPE: ESI-QTOF
AC$MASS_SPECTROMETRY: MS_TYPE MS2
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION ESI
AC$MASS_SPECTROMETRY: COLLISION_ENERGY 40
MS$FOCUSED_ION: PRECURSOR_M/Z 126.054954927
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0
PK$SPLASH: splash10-000x-9000000000-8ffaef43d58b56ecf451
PK$NUM_PEAK: 19
PK$PEAK: m/z int. rel.int.
39.022927 5.922443 59
41.026001 1.379042 13
42.010016 3.096407 30
53.002191 3.382609 33
54.010016 1.312335 13
54.033826 41.889524 418
54.054955 1.523239 15
55.017841 12.574842 125
55.041651 5.886855 58
56.025666 2.366676 23
57.020915 1.710408 17
59.036565 1.354008 13
66.033826 30.633713 306
67.017841 2.340839 23
82.02874 3.577384 35
83.036565 68.830443 687
94.02874 99.999997 999
94.065126 1.886805 18
111.03148 15.979943 159
//