ACCESSION: MSBNK-EPA-ENTACT_AGILENT000532
RECORD_TITLE: 3,4,5,6-Tetrachloropyridine-2-carboxylic acid; ESI-QTOF; MS2; CE: 40; [M-H]-
DATE: 2023.05.02
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: 3,4,5,6-Tetrachloropyridine-2-carboxylic acid
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₆HCl₄NO₂
CH$EXACT_MASS: 258.8761391239
CH$SMILES: OC(=O)C1N=C(Cl)C(Cl)=C(Cl)C=1Cl
CH$IUPAC: InChI=1S/C6HCl4NO2/c7-1-2(8)4(6(12)13)11-5(10)3(1)9/h(H,12,13)
CH$LINK: CAS 10469-09-7
CH$LINK: INCHIKEY GXFRQLQUKBSYQL-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:82646

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 40

MS$FOCUSED_ION: PRECURSOR_M/Z 257.8688626722
MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-001i-9000000000-8e659a30b88a9a5650ba
PK$NUM_PEAK: 1
PK$PEAK: m/z int. rel.int.
34.969401 100.000001 999
//