ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001592
RECORD_TITLE: 2,3-DIMETHYLNAPHTHALENE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KOGA M, UNIV. OF OCCUPATIONAL AND ENVIRONMENTAL HEALTH
LICENSE: CC BY-NC-SA

CH$NAME: 2,3-DIMETHYLNAPHTHALENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₂H₁₂
CH$EXACT_MASS: 156.09390
CH$SMILES: Cc(c1)c(C)cc(c2)c(ccc2)1
CH$IUPAC: InChI=1S/C12H12/c1-9-7-11-5-3-4-6-12(11)8-10(9)2/h3-8H,1-2H3
CH$LINK: CAS 581-40-8
CH$LINK: INCHIKEY WWGUMAYGTYQSGA-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID2060383

AC$INSTRUMENT: VARIAN MAT-44
AC$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$SPLASH: splash10-0a6u-6900000000-7eab7a960bf2588f7c6f
PK$NUM_PEAK: 47
PK$PEAK: m/z int. rel.int.
  41 1.91 19
  50 13.78 138
  51 34.2 342
  52 5.41 54
  53 2.61 26
  57 2.61 26
  58 4.01 40
  61 1.91 19
  62 10.64 106
  63 33.68 337
  64 18.84 188
  65 7.15 72
  69 2.26 23
  70 5.93 59
  71 2.44 24
  74 8.37 84
  75 11.86 119
  76 31.23 312
  77 24.08 241
  78 13.78 138
  86 2.79 28
  87 4.18 42
  88 1.57 16
  89 6.45 65
  91 1.22 12
  98 1.04 10
  101 1.04 10
  102 3.49 35
  113 1.74 17
  114 1.74 17
  115 30.36 304
  116 3.14 31
  126 2.61 26
  127 8.55 86
  128 16.23 162
  129 6.98 70
  139 7.85 79
  140 5.41 54
  141 71.43 714
  142 12.73 127
  151 3.14 31
  152 10.47 105
  153 10.64 106
  154 5.23 52
  155 26.52 265
  156 99.99 999
  157 13.78 138
//