ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001650
RECORD_TITLE: PARA-METHOXYTOLUENE; 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$NAME: PARA-METHOXYTOLUENE
CH$NAME: PARA-METHYLANISOLE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₈H₁₀O
CH$EXACT_MASS: 122.07316
CH$SMILES: COc(c1)ccc(C)c1
CH$IUPAC: InChI=1S/C8H10O/c1-7-3-5-8(9-2)6-4-7/h3-6H,1-2H3
CH$LINK: INCHIKEY CHLICZRVGGXEOD-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID9026710

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$SPLASH: splash10-00di-7900000000-7f556bdac6b787d60bd9
PK$NUM_PEAK: 30
PK$PEAK: m/z int. rel.int.
  15 1.72 17
  27 5.26 53
  28 1.29 13
  38 1.72 17
  39 9.6 96
  41 1.61 16
  50 4.83 48
  51 10.41 104
  52 5.79 58
  53 5.36 54
  61 1.39 14
  62 1.77 18
  63 4.77 48
  64 1.5 15
  65 6.71 67
  75 1.13 11
  77 32.73 327
  78 7.99 80
  79 23.23 232
  80 1.61 16
  89 2.47 25
  90 2.04 20
  91 23.07 231
  92 8.05 81
  93 1.56 16
  107 33.26 333
  108 3 30
  121 50.05 501
  122 99.99 999
  123 8.48 85
//