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MassBank Record: MSBNK-EPA-ENTACT_AGILENT001442

Salicylhydroxamic acid; ESI-QTOF; MS2; CE: 20; [M+H]+

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

ACCESSION: MSBNK-EPA-ENTACT_AGILENT001442
RECORD_TITLE: Salicylhydroxamic acid; ESI-QTOF; MS2; CE: 20; [M+H]+
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: Salicylhydroxamic acid
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C7H7NO3
CH$EXACT_MASS: 153.0425930976
CH$SMILES: OC1C=CC=CC=1C(=O)NO
CH$IUPAC: InChI=1S/C7H7NO3/c9-6-4-2-1-3-5(6)7(10)8-11/h1-4,9,11H,(H,8,10)
CH$LINK: CAS 89-73-6
CH$LINK: INCHIKEY HBROZNQEVUILML-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:66644

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$FOCUSED_ION: PRECURSOR_M/Z 154.0498695493
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-001i-9300000000-0f265933e7229f1dc5a6
PK$NUM_PEAK: 16
PK$PEAK: m/z int. rel.int.
  39.022927 1.015441 10
  53.038577 3.52523 35
  63.994366 1.516603 15
  65.038577 14.788435 147
  79.017841 5.195252 51
  80.025666 1.030074 10
  80.049476 100.000003 999
  90.033826 9.175958 91
  92.025666 2.179894 21
  93.033491 9.654471 96
  95.049141 1.078411 10
  108.04439 6.745427 67
  119.036565 6.718903 67
  120.020581 2.612174 26
  121.028406 37.639194 376
  136.039305 1.203972 12
//

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