MassBank Record: MSBNK-EPA-ENTACT_AGILENT002276

4-Chloropyridine 1-oxide; ESI-QTOF; MS2; CE: 10; [M+H]+

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ACCESSION: MSBNK-EPA-ENTACT_AGILENT002276
RECORD_TITLE: 4-Chloropyridine 1-oxide; ESI-QTOF; MS2; CE: 10; [M+H]+
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

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CH$NAME: 4-Chloropyridine 1-oxide
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₅H₄ClNO
CH$EXACT_MASS: 128.9981414673
CH$SMILES: [O-][N+]1C=CC(Cl)=CC=1
CH$IUPAC: InChI=1S/C5H4ClNO/c6-5-1-3-7(8)4-2-5/h1-4H
CH$LINK: CAS 1121-76-2
CH$LINK: INCHIKEY DPJVRASYWYOFSJ-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:70724

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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

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MS$FOCUSED_ION: PRECURSOR_M/Z 130.005417919
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

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PK$SPLASH: splash10-001i-0900000000-2350871f633612abd945
PK$NUM_PEAK: 3
PK$PEAK: m/z int. rel.int.
  78.033826 1.335789 13
  113.002678 10.830298 108
  130.005418 99.999996 999
//