ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008867
RECORD_TITLE: 3,4-XYLIDINE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAJIMA S, GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA

CH$NAME: 3,4-XYLIDINE
CH$NAME: 3,4-DIMETHYLANILINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₈H₁₁N
CH$EXACT_MASS: 121.08915
CH$SMILES: Nc(c1)cc(C)c(C)c1
CH$IUPAC: InChI=1S/C8H11N/c1-6-3-4-8(9)5-7(6)2/h3-5H,9H2,1-2H3
CH$LINK: INCHIKEY DOLQYFPDPKPQSS-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID3026308

AC$INSTRUMENT: HITACHI RMU-7M
AC$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$SPLASH: splash10-00di-2900000000-42d06b34b7a8ae4224ac
PK$NUM_PEAK: 35
PK$PEAK: m/z int. rel.int.
  27 2.37 24
  28 2.92 29
  30 1.1 11
  39 5.5 55
  41 2.86 29
  42 2.37 24
  50 1.98 20
  51 4.51 45
  52 3.3 33
  53 4.18 42
  54 1.65 17
  58.5 2.2 22
  59.5 1.93 19
  60.5 1.38 14
  63 2.15 22
  65 4.02 40
  66 1.76 18
  77 11.83 118
  78 3.58 36
  79 3.41 34
  80 2.48 25
  91 8.14 81
  92 2.15 22
  93 5.23 52
  94 1.87 19
  103 2.75 28
  104 2.48 25
  105 1.6 16
  106 56.71 567
  107 6.05 61
  118 3.74 37
  119 3.58 36
  120 81.02 810
  121 99.99 999
  122 11.66 117
//