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MassBank Record: MSBNK-EPA-ENTACT_AGILENT001443

Salicylhydroxamic acid; ESI-QTOF; MS2; CE: 10; [M+H]+

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

ACCESSION: MSBNK-EPA-ENTACT_AGILENT001443
RECORD_TITLE: Salicylhydroxamic acid; ESI-QTOF; MS2; CE: 10; [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 10

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$SPLASH: splash10-0zn9-3900000000-36851f3eaf3fd750292b
PK$NUM_PEAK: 15
PK$PEAK: m/z int. rel.int.
  53.038577 2.009148 20
  58.065126 1.174485 11
  65.038577 4.57212 45
  79.017841 16.061103 160
  80.025666 2.589118 25
  80.049476 53.423138 533
  81.020915 1.79966 17
  90.031145 1.803905 18
  93.033491 3.652024 36
  95.049141 1.919482 19
  108.04439 53.896139 538
  119.036565 2.085449 20
  121.028406 79.930547 798
  136.039305 9.054767 90
  154.04987 100.000004 999
//

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