MassBank Record: JP010467

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ORTHO-AMINOPHENOL; EI-B; MS

Mass Spectrum
Chemical Structure
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ACCESSION: JP010467
RECORD_TITLE: ORTHO-AMINOPHENOL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAJIMA S, GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA

CH$NAME: ORTHO-AMINOPHENOL
CH$NAME: ORTHO-HYDROXYANILINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C6H7NO
CH$EXACT_MASS: 109.052760000000006357367965392768383026123046875
CH$SMILES: Nc(c1)c(O)ccc1
CH$IUPAC: InChI=1S/C6H7NO/c7-5-3-1-2-4-6(5)8/h1-4,8H,7H2
CH$LINK: COMPTOX DTXSID8024498
CH$LINK: INCHIKEY CDAWCLOXVUBKRW-UHFFFAOYSA-N

AC$INSTRUMENT: HITACHI M-80A
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-0a59-9500000000-64a0083db1618cc2d030
PK$NUM_PEAK: 34
PK$PEAK: m/z int. rel.int.
  26 3.52 35
  27 8.37 84
  28 9.88 99
  29 3.73 37
  30 1.25 13
  37 2.38 24
  38 5.21 52
  39 9.63 96
  40 3 30
  41 4.83 48
  42 2.69 27
  49 1.37 14
  50 5.5 55
  51 7.13 71
  52 12.47 125
  53 16.25 163
  54 7.98 80
  55 2.66 27
  61 1.01 10
  62 1.86 19
  63 7.97 80
  64 7.65 77
  65 3.17 32
  66 1.33 13
  76 1 10
  78 1.69 17
  79 1.55 16
  80 51.86 519
  81 6.1 61
  91 1.91 19
  92 1.63 16
  108 7.23 72
  109 99.99 999
  110 12.37 124
//