ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007129
RECORD_TITLE: 1,2,3-TRIMETHYLBENZENE; 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$NAME: 1,2,3-TRIMETHYLBENZENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₉H₁₂
CH$EXACT_MASS: 120.09390
CH$SMILES: Cc(c1)c(C)c(C)cc1
CH$IUPAC: InChI=1S/C9H12/c1-7-5-4-6-8(2)9(7)3/h4-6H,1-3H3
CH$LINK: CAS 526-73-8
CH$LINK: INCHIKEY FYGHSUNMUKGBRK-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID8047769

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$SPLASH: splash10-0a4i-4900000000-82bebdcf0868386b88db
PK$NUM_PEAK: 32
PK$PEAK: m/z int. rel.int.
  15 1.27 13
  27 5.1 51
  38 1.26 13
  39 10.22 102
  40 1.15 12
  41 3.55 36
  50 2.85 29
  51 6.92 69
  52 2.28 23
  53 3.25 33
  58 1.38 14
  59 1.5 15
  62 1.36 14
  63 4.15 42
  65 4.6 46
  74 1.04 10
  77 12.53 125
  78 4.46 45
  79 6.43 64
  89 1.26 13
  91 9.24 92
  92 1.58 16
  102 1.43 14
  103 5.39 54
  104 2.56 26
  105 99.99 999
  106 7.27 73
  115 2.87 29
  117 2.41 24
  119 10.62 106
  120 48.09 481
  121 4.18 42
//