ACCESSION: MSBNK-EPA-ENTACT_AGILENT000363
RECORD_TITLE: 6-Chloro-2-picolinic acid; ESI-QTOF; MS2; CE: 10; [M+H]+
DATE: 2023.05.02
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: 6-Chloro-2-picolinic acid
CH$NAME: DTXSID7040289
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₆H₄ClNO₂
CH$EXACT_MASS: 156.9930560896
CH$SMILES: OC(=O)C1C=CC=C(Cl)N=1
CH$IUPAC: InChI=1S/C6H4ClNO2/c7-5-3-1-2-4(8-5)6(9)10/h1-3H,(H,9,10)
CH$LINK: CAS 4684-94-0
CH$LINK: INCHIKEY ZLKMOIHCHCMSFW-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:20812

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 10

MS$FOCUSED_ION: PRECURSOR_M/Z 158.0003325413
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-0059-9000000000-5d170a4ce5b6cda035c3
PK$NUM_PEAK: 9
PK$PEAK: m/z int. rel.int.
  61.007276 1.035377 10
  63.994853 4.733402 47
  65.002191 1.339218 13
  79.017841 100.000002 999
  80.025666 83.620299 835
  81.020915 2.043941 20
  111.994853 4.032774 40
  139.989768 6.244808 62
  158.000333 1.242407 12
//