MassBank Record: MSBNK-EPA-ENTACT_AGILENT001442
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
//
system version 2.2.8-SNAPSHOT