ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008901
RECORD_TITLE: 1,2,3,5-TETRAMETHYLBENZENE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: 1,2,3,5-TETRAMETHYLBENZENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₀H₁₄
CH$EXACT_MASS: 134.10955
CH$SMILES: Cc(c1)cc(C)c(C)c(C)1
CH$IUPAC: InChI=1S/C10H14/c1-7-5-8(2)10(4)9(3)6-7/h5-6H,1-4H3
CH$LINK: INCHIKEY BFIMMTCNYPIMRN-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID6026119

AC$INSTRUMENT: HITACHI RMU-6M
AC$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$SPLASH: splash10-0159-3900000000-7c2a123567f711eb34db
PK$NUM_PEAK: 40
PK$PEAK: m/z int. rel.int.
  27 5.6 56
  29 1 10
  38 1.1 11
  39 1.1 11
  40 1.5 15
  41 8.3 83
  50 2.6 26
  51 0.76 8
  52 2.6 26
  53 4.1 41
  57.5 1.1 11
  58 0.1 1
  62 1.5 15
  63 4.1 41
  64 2.2 22
  65 0.69 7
  66 2.1 21
  67 1.7 17
  74 1.1 11
  75 0.12 1
  77 9.5 95
  78 3.2 32
  79 4.3 43
  89 0.15 2
  91 16 160
  92 1.8 18
  93 1.8 18
  102 0.12 1
  103 4.1 41
  104 2.8 28
  105 4.3 43
  115 0.65 7
  116 2.5 25
  117 6.9 69
  118 2.6 26
  119 99.99 999
  120 10.1 101
  133 10.7 107
  134 54.7 547
  135 6.6 66
//