ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP003554
RECORD_TITLE: 3,5-DI-TERT-BUTYL-4-HYDROXYTOLUENE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA

CH$NAME: 3,5-DI-TERT-BUTYL-4-HYDROXYTOLUENE
CH$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$INSTRUMENT: Unknown
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-0a4i-7490000000-b8f13a22c093b1883667
PK$NUM_PEAK: 33
PK$PEAK: m/z int. rel.int.
  18 3.43 34
  29 9.63 96
  39 2.31 23
  41 17.29 173
  43 3.26 33
  55 9.89 99
  57 40.3 403
  67 9.24 92
  69 2.78 28
  77 3.77 38
  79 3.13 31
  81 11.8 118
  91 6.62 66
  95 6.37 64
  105 8.31 83
  115 3.71 37
  119 4.62 46
  121 4.21 42
  128 2.43 24
  129 2.93 29
  131 5.1 51
  133 2.74 27
  145 16.74 167
  149 3.36 34
  161 6.34 63
  163 2.99 30
  177 7.61 76
  189 5.27 53
  203 2.98 30
  205 99.99 999
  206 15.75 158
  220 25.14 251
  221 4.03 40
//