ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008432
RECORD_TITLE: 2,6-BIS(1,1-DIMETHYLETHYL)-4-METHYLPHENOL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SODA AROMATIC CO., LTD.
LICENSE: CC BY-NC-SA

CH$NAME: 2,6-BIS(1,1-DIMETHYLETHYL)-4-METHYLPHENOL
CH$NAME: BHT
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₅H₂₄O
CH$EXACT_MASS: 220.18272
CH$SMILES: Cc(c1)cc(C(C)(C)C)c(O)c1C(C)(C)C
CH$IUPAC: InChI=1S/C15H24O/c1-10-8-11(14(2,3)4)13(16)12(9-10)15(5,6)7/h8-9,16H,1-7H3
CH$LINK: INCHIKEY NLZUEZXRPGMBCV-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID2020216

AC$INSTRUMENT: HITACHI M-80B
AC$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$SPLASH: splash10-0a4i-4490000000-a19c5b42b06567024d6f
PK$NUM_PEAK: 55
PK$PEAK: m/z int. rel.int.
  15 1.16 12
  27 1.83 18
  28 2.15 22
  29 4.47 45
  39 3.03 30
  41 9.34 93
  43 1.98 20
  51 1.26 13
  53 1.95 20
  55 4.75 48
  57 15.86 159
  65 1.93 19
  67 4 40
  69 1.44 14
  77 3.53 35
  78 1.19 12
  79 2.06 21
  81 4.2 42
  91 5.36 54
  93 1.05 11
  95 2.74 27
  103 1.22 12
  105 5.8 58
  107 1.03 10
  115 3.92 39
  116 1.84 18
  117 1.94 19
  119 3.41 34
  121 2.22 22
  127 1.09 11
  128 3.06 31
  129 2.93 29
  130 1.61 16
  131 3.09 31
  133 2.92 29
  135 1.28 13
  141 2.18 22
  142 1.9 19
  143 1.25 13
  145 10.21 102
  146 1.42 14
  147 1.46 15
  149 1.23 12
  157 1.22 12
  159 1.39 14
  161 2.66 27
  163 1.66 17
  175 1.11 11
  177 3.51 35
  189 3.2 32
  205 99.99 999
  206 16.09 161
  207 1.42 14
  220 26.4 264
  221 3.95 40
//