ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP011773
RECORD_TITLE: 1,3-DIHYDROXYBENZENE; 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$NAME: 1,3-DIHYDROXYBENZENE
CH$NAME: RESORCINOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₆H₆O₂
CH$EXACT_MASS: 110.03678
CH$SMILES: Oc(c1)cc(O)cc1
CH$IUPAC: InChI=1S/C6H6O2/c7-5-2-1-3-6(8)4-5/h1-4,7-8H
CH$LINK: INCHIKEY GHMLBKRAJCXXBS-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID2021238

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$SPLASH: splash10-03e9-9300000000-fcd22d3e2208eda085dd
PK$NUM_PEAK: 39
PK$PEAK: m/z int. rel.int.
  26 3.62 36
  27 10.88 109
  29 10.36 104
  37 5.77 58
  38 10.8 108
  39 22.72 227
  40 3.33 33
  41 5.73 57
  42 7.57 76
  43 4.85 49
  49 2.8 28
  50 9.01 90
  51 10.9 109
  52 6.95 70
  53 29.87 299
  54 10.98 110
  55 15.95 160
  56 1.1 11
  61 4.71 47
  62 7.26 73
  63 14.2 142
  64 10.96 110
  65 4.04 40
  66 3.08 31
  68 4.55 46
  69 19.14 191
  70 1.13 11
  71 3.43 34
  74 1.02 10
  79 1.5 15
  81 41.76 418
  82 30.25 303
  83 1.67 17
  92 1.9 19
  95 3.57 36
  109 4.22 42
  110 99.99 999
  111 12.05 121
  112 1.25 13
//