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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP009493

SALICYLALDOXIME; EI-B; MS

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

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009493
RECORD_TITLE: SALICYLALDOXIME; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: NARA WOMEN'S UNIVERSITY
LICENSE: CC BY-NC-SA

CH$NAME: SALICYLALDOXIME
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C7H7NO2
CH$EXACT_MASS: 137.04768
CH$SMILES: ON=Cc(c1)c(O)ccc1
CH$IUPAC: InChI=1S/C7H7NO2/c9-7-4-2-1-3-6(7)5-8-10/h1-5,9-10H/b8-5+
CH$LINK: CAS 94-67-7
CH$LINK: INCHIKEY ORIHZIZPTZTNCU-VMPITWQZSA-N

AC$INSTRUMENT: HITACHI M-80
AC$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$SPLASH: splash10-0006-9000000000-430bbc09a57679173581
PK$NUM_PEAK: 40
PK$PEAK: m/z int. rel.int.
  17 1.5 15
  18 3.22 32
  19 1.16 12
  26 2.55 26
  27 4.77 48
  28 11.25 113
  29 2.74 27
  30 3.42 34
  37 3.91 39
  38 9.93 99
  39 24.09 241
  40 2.12 21
  41 4.17 42
  44 2.01 20
  50 6.15 62
  51 10.21 102
  52 9.32 93
  53 6.49 65
  54 1.55 16
  55 1.35 14
  61 2.56 26
  62 5.77 58
  63 19.79 198
  64 26.7 267
  65 24.61 246
  66 3.59 36
  68 1.18 12
  74 2.08 21
  75 2.75 28
  76 2.36 24
  77 6.75 68
  78 4.23 42
  80 2.74 27
  81 2.05 21
  90 2.4 24
  91 99.99 999
  92 15.47 155
  93 3.65 37
  94 1.97 20
  102 8.41 84
//

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