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MassBank Record: MSBNK-EPA-ENTACT_AGILENT001194

6-Methyl-3-hydroxypyridine; ESI-QTOF; MS2; CE: 10; [M-H]-

Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk)

ACCESSION: MSBNK-EPA-ENTACT_AGILENT001194
RECORD_TITLE: 6-Methyl-3-hydroxypyridine; ESI-QTOF; MS2; CE: 10; [M-H]-
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: 6-Methyl-3-hydroxypyridine
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C6H7NO
CH$EXACT_MASS: 109.052763853
CH$SMILES: CC1C=CC(O)=CN=1
CH$IUPAC: InChI=1S/C6H7NO/c1-5-2-3-6(8)4-7-5/h2-4,8H,1H3
CH$LINK: CAS 1121-78-4
CH$LINK: INCHIKEY DHLUJPLHLZJUBW-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:14275

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 10

MS$FOCUSED_ION: PRECURSOR_M/Z 108.0454874013
MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-0a4i-0900000000-1491be7a245945b05414
PK$NUM_PEAK: 4
PK$PEAK: m/z int. rel.int.
  80.050573 2.661586 26
  93.022012 1.377615 13
  107.037662 6.311055 63
  108.045487 99.999996 999
//

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