ACCESSION: MSBNK-EPA-ENTACT_AGILENT000362
RECORD_TITLE: 6-Chloro-2-picolinic acid; ESI-QTOF; MS2; CE: 20; [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 20

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$SPLASH: splash10-0059-9000000000-3061d635cc5528b21cce
PK$NUM_PEAK: 10
PK$PEAK: m/z int. rel.int.
  47.00018 2.319429 23
  61.007276 5.989115 59
  62.015101 5.124631 51
  63.022927 1.079951 10
  63.994853 23.968033 239
  65.002191 7.591978 75
  79.017841 99.999999 999
  80.025666 83.649225 835
  81.020915 1.759694 17
  111.994853 13.587963 135
//