ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP010799
RECORD_TITLE: TRIMETHYLHYDROQUINONE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: FUJISE Y, HAMAMATSU UNIV. SCHOOL OF MEDICINE
LICENSE: CC BY-NC-SA

CH$NAME: TRIMETHYLHYDROQUINONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₉H₁₂O₂
CH$EXACT_MASS: 152.08373
CH$SMILES: Cc(c1)c(O)c(C)c(C)c(O)1
CH$IUPAC: InChI=1S/C9H12O2/c1-5-4-8(10)6(2)7(3)9(5)11/h4,10-11H,1-3H3
CH$LINK: INCHIKEY AUFZRCJENRSRLY-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID7052446

AC$INSTRUMENT: JEOL JMS-D-300
AC$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$SPLASH: splash10-0udi-4900000000-53197de66212fda82cde
PK$NUM_PEAK: 49
PK$PEAK: m/z int. rel.int.
  41 5.11 51
  43 6.08 61
  50 2.91 29
  51 6.68 67
  52 3.69 37
  53 9.17 92
  54 10.75 108
  55 3.77 38
  62 1.15 12
  63 1.89 19
  65 3.2 32
  66 2.35 24
  67 5.31 53
  68 17.33 173
  69 5.94 59
  75 1.25 13
  76 5.1 51
  77 8.18 82
  78 2.27 23
  79 16.38 164
  80 1.88 19
  81 2.69 27
  82 3.38 34
  83 1.43 14
  91 6.42 64
  93 3.89 39
  94 3.93 39
  95 1.98 20
  96 8.37 84
  103 1.01 10
  105 1.85 19
  107 19.27 193
  108 3.52 35
  109 8.56 86
  110 2.06 21
  119 2.28 23
  121 6.97 70
  122 11.59 116
  123 5.32 53
  124 1.19 12
  133 2.74 27
  134 1.62 16
  135 6.9 69
  137 50.64 506
  138 4.75 48
  150 56.87 569
  151 29.63 296
  152 99.99 999
  153 10.34 103
//